4-[dibenzofuran-4-yl(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)amino]benzonitrile;N,6-diphenyl-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(4-fluorophenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(2-methylphenyl)-6-phenyl-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(2-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(3-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(4-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)-N-(4-trimethylsilylphenyl)dibenzofuran-4-amine

C339H212FN9O8S8Si — CID 158985996

IUPAC4-[dibenzofuran-4-yl(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)amino]benzonitrile;N,6-diphenyl-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(4-fluorophenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(2-methylphenyl)-6-phenyl-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(2-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(3-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(4-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)-N-(4-trimethylsilylphenyl)dibenzofuran-4-amine
SMILESC[Si](C)(C)c1ccc(N(c2cc3c4cc5ccccc5cc4sc3c3ccccc23)c2cccc3c2oc2ccccc23)cc1.Cc1ccccc1N(c1cc2c3cc4ccccc4cc3sc2c2ccccc12)c1cccc2c1oc1c(-c3ccccc3)cccc12.Fc1ccc(N(c2cc3c4cc5ccccc5cc4sc3c3ccccc23)c2cccc3c2oc2ccccc23)cc1.N#Cc1ccc(N(c2cc3c4cc5ccccc5cc4sc3c3ccccc23)c2cccc3c2oc2ccccc23)cc1.c1ccc(-c2ccc(N(c3cc4c5cc6ccccc6cc5sc4c4ccccc34)c3cccc4c3oc3ccccc34)cc2)cc1.c1ccc(-c2cccc(N(c3cc4c5cc6ccccc6cc5sc4c4ccccc34)c3cccc4c3oc3ccccc34)c2)cc1.c1ccc(-c2cccc3c2oc2c(N(c4ccccc4)c4cc5c6cc7ccccc7cc6sc5c5ccccc45)cccc23)cc1.c1ccc(-c2ccccc2N(c2cc3c4cc5ccccc5cc4sc3c3ccccc23)c2cccc3c2oc2ccccc23)cc1
InChIInChI=1S/C45H29NOS.4C44H27NOS.C41H31NOSSi.C39H22N2OS.C38H22FNOS/c1-28-13-5-10-23-39(28)46(40-24-12-22-35-34-21-11-20-32(43(34)47-44(35)40)29-14-3-2-4-15-29)41-27-38-37-25-30-16-6-7-17-31(30)26-42(37)48-45(38)36-19-9-8-18-33(36)41;1-3-13-28(14-4-1)32-21-11-22-34-35-23-12-24-39(43(35)46-42(32)34)45(31-17-5-2-6-18-31)40-27-38-37-25-29-15-7-8-16-30(29)26-41(37)47-44(38)36-20-10-9-19-33(36)40;1-2-13-28(14-3-1)31-17-8-10-22-38(31)45(39-23-12-21-34-33-19-9-11-24-41(33)46-43(34)39)40-27-37-36-25-29-15-4-5-16-30(29)26-42(36)47-44(37)35-20-7-6-18-32(35)40;1-2-12-28(13-3-1)29-16-10-17-32(24-29)45(39-22-11-21-35-34-19-8-9-23-41(34)46-43(35)39)40-27-38-37-25-30-14-4-5-15-31(30)26-42(37)47-44(38)36-20-7-6-18-33(36)40;1-2-11-28(12-3-1)29-21-23-32(24-22-29)45(39-19-10-18-35-34-16-8-9-20-41(34)46-43(35)39)40-27-38-37-25-30-13-4-5-14-31(30)26-42(37)47-44(38)36-17-7-6-15-33(36)40;1-45(2,3)29-21-19-28(20-22-29)42(36-17-10-16-32-31-14-8-9-18-38(31)43-40(32)36)37-25-35-34-23-26-11-4-5-12-27(26)24-39(34)44-41(35)33-15-7-6-13-30(33)37;40-23-24-16-18-27(19-17-24)41(34-14-7-13-30-29-11-5-6-15-36(29)42-38(30)34)35-22-33-32-20-25-8-1-2-9-26(25)21-37(32)43-39(33)31-12-4-3-10-28(31)35;39-25-16-18-26(19-17-25)40(33-14-7-13-29-28-11-5-6-15-35(28)41-37(29)33)34-22-32-31-20-23-8-1-2-9-24(23)21-36(31)42-38(32)30-12-4-3-10-27(30)34/h2-27H,1H3;4*1-27H;4-25H,1-3H3;1-22H;1-22H
InChIKeyJPOPOQAJIXRIHJ-UHFFFAOYSA-N
MW4843.10 g/mol
LogP103.04
Rot. Bonds30

About 4-[dibenzofuran-4-yl(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)amino]benzonitrile;N,6-diphenyl-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(4-fluorophenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(2-methylphenyl)-6-phenyl-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(2-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(3-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(4-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)-N-(4-trimethylsilylphenyl)dibenzofuran-4-amine

4-[dibenzofuran-4-yl(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)amino]benzonitrile;N,6-diphenyl-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(4-fluorophenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(2-methylphenyl)-6-phenyl-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(2-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(3-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(4-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)-N-(4-trimethylsilylphenyl)dibenzofuran-4-amine (PubChem CID 158985996) has the molecular formula C339H212FN9O8S8Si and a molecular weight of 4843.10 g/mol. Its IUPAC name is 4-[dibenzofuran-4-yl(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)amino]benzonitrile;N,6-diphenyl-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(4-fluorophenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(2-methylphenyl)-6-phenyl-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(2-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(3-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(4-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)-N-(4-trimethylsilylphenyl)dibenzofuran-4-amine.

Molecular Properties

Compound Name4-[dibenzofuran-4-yl(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)amino]benzonitrile;N,6-diphenyl-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(4-fluorophenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(2-methylphenyl)-6-phenyl-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(2-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(3-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(4-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)-N-(4-trimethylsilylphenyl)dibenzofuran-4-amine
PubChem CID158985996
Molecular FormulaC339H212FN9O8S8Si
Molecular Weight4843.10 g/mol
Exact Mass4838.40
IUPAC Name4-[dibenzofuran-4-yl(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)amino]benzonitrile;N,6-diphenyl-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(4-fluorophenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(2-methylphenyl)-6-phenyl-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(2-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(3-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(4-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)-N-(4-trimethylsilylphenyl)dibenzofuran-4-amine
SMILESC[Si](C)(C)c1ccc(N(c2cc3c4cc5ccccc5cc4sc3c3ccccc23)c2cccc3c2oc2ccccc23)cc1.Cc1ccccc1N(c1cc2c3cc4ccccc4cc3sc2c2ccccc12)c1cccc2c1oc1c(-c3ccccc3)cccc12.Fc1ccc(N(c2cc3c4cc5ccccc5cc4sc3c3ccccc23)c2cccc3c2oc2ccccc23)cc1.N#Cc1ccc(N(c2cc3c4cc5ccccc5cc4sc3c3ccccc23)c2cccc3c2oc2ccccc23)cc1.c1ccc(-c2ccc(N(c3cc4c5cc6ccccc6cc5sc4c4ccccc34)c3cccc4c3oc3ccccc34)cc2)cc1.c1ccc(-c2cccc(N(c3cc4c5cc6ccccc6cc5sc4c4ccccc34)c3cccc4c3oc3ccccc34)c2)cc1.c1ccc(-c2cccc3c2oc2c(N(c4ccccc4)c4cc5c6cc7ccccc7cc6sc5c5ccccc45)cccc23)cc1.c1ccc(-c2ccccc2N(c2cc3c4cc5ccccc5cc4sc3c3ccccc23)c2cccc3c2oc2ccccc23)cc1
InChIInChI=1S/C45H29NOS.4C44H27NOS.C41H31NOSSi.C39H22N2OS.C38H22FNOS/c1-28-13-5-10-23-39(28)46(40-24-12-22-35-34-21-11-20-32(43(34)47-44(35)40)29-14-3-2-4-15-29)41-27-38-37-25-30-16-6-7-17-31(30)26-42(37)48-45(38)36-19-9-8-18-33(36)41;1-3-13-28(14-4-1)32-21-11-22-34-35-23-12-24-39(43(35)46-42(32)34)45(31-17-5-2-6-18-31)40-27-38-37-25-29-15-7-8-16-30(29)26-41(37)47-44(38)36-20-10-9-19-33(36)40;1-2-13-28(14-3-1)31-17-8-10-22-38(31)45(39-23-12-21-34-33-19-9-11-24-41(33)46-43(34)39)40-27-37-36-25-29-15-4-5-16-30(29)26-42(36)47-44(37)35-20-7-6-18-32(35)40;1-2-12-28(13-3-1)29-16-10-17-32(24-29)45(39-22-11-21-35-34-19-8-9-23-41(34)46-43(35)39)40-27-38-37-25-30-14-4-5-15-31(30)26-42(37)47-44(38)36-20-7-6-18-33(36)40;1-2-11-28(12-3-1)29-21-23-32(24-22-29)45(39-19-10-18-35-34-16-8-9-20-41(34)46-43(35)39)40-27-38-37-25-30-13-4-5-14-31(30)26-42(37)47-44(38)36-17-7-6-15-33(36)40;1-45(2,3)29-21-19-28(20-22-29)42(36-17-10-16-32-31-14-8-9-18-38(31)43-40(32)36)37-25-35-34-23-26-11-4-5-12-27(26)24-39(34)44-41(35)33-15-7-6-13-30(33)37;40-23-24-16-18-27(19-17-24)41(34-14-7-13-30-29-11-5-6-15-36(29)42-38(30)34)35-22-33-32-20-25-8-1-2-9-26(25)21-37(32)43-39(33)31-12-4-3-10-28(31)35;39-25-16-18-26(19-17-25)40(33-14-7-13-29-28-11-5-6-15-35(28)41-37(29)33)34-22-32-31-20-23-8-1-2-9-24(23)21-36(31)42-38(32)30-12-4-3-10-27(30)34/h2-27H,1H3;4*1-27H;4-25H,1-3H3;1-22H;1-22H
InChIKeyJPOPOQAJIXRIHJ-UHFFFAOYSA-N
XLogP103.04
TPSA154.83 Ų
H-Bond Donors
H-Bond Acceptors25
Rotatable Bonds30
Heavy Atoms366
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004843.10
LogP ≤ 5103.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1025

Analyze 4-[dibenzofuran-4-yl(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)amino]benzonitrile;N,6-diphenyl-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(4-fluorophenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(2-methylphenyl)-6-phenyl-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(2-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(3-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(4-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)-N-(4-trimethylsilylphenyl)dibenzofuran-4-amine with MolForge

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Related Compounds

4-N,20-N-bis(2-methylphenyl)-4-N,20-N-bis(6-phenyldibenzofuran-4-yl)-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;4-[dibenzofuran-4-yl-[20-(N-dibenzofuran-4-yl-4-isocyanoanilino)-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-4-yl]amino]benzonitrile;4-N,20-N-di(dibenzofuran-4-yl)-4-N,20-N-bis(4-fluorophenyl)-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;4-N,20-N-di(dibenzofuran-4-yl)-4-N-(4-methylphenyl)-20-N-(4-trimethylsilylphenyl)-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;4-N,20-N-diphenyl-4-N,20-N-bis(6-phenyldibenzofuran-4-yl)-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine
CID 158992079
9-N,20-N-bis(4-fluorophenyl)-9-N,20-N-diphenyl-12-thiapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine;4-(N-[9-(N-(4-cyanophenyl)anilino)-12-thiapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-20-yl]anilino)benzonitrile;9-N,20-N-dinaphthalen-2-yl-9-N,20-N-diphenyl-12-thiapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine;9-N,20-N-diphenyl-9-N,20-N-bis(2-phenylphenyl)-12-thiapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine;9-N,20-N-diphenyl-9-N,20-N-bis(3-phenylphenyl)-12-thiapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine;9-N,20-N-diphenyl-9-N,20-N-bis(4-phenylphenyl)-12-thiapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine;9-N,20-N-diphenyl-9-N,20-N-bis(4-trimethylsilylphenyl)-12-thiapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine
CID 162235423
9-N,20-N-bis(2-methylphenyl)-9-N,20-N-bis(6-phenyldibenzofuran-4-yl)-12-thiapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine;9-N,20-N-di(dibenzofuran-4-yl)-20-N-(4-methylphenyl)-9-N-(4-trimethylsilylphenyl)-12-thiapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine;9-N,20-N-di(phenanthren-9-yl)-9-N,20-N-diphenyl-12-thiapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine;9-N,20-N-diphenyl-9-N,20-N-bis(6-phenyldibenzofuran-4-yl)-12-thiapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,20-diamine
CID 161382791
N-(2-methylphenyl)-N-(6-phenyldibenzofuran-4-yl)-12-oxapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-amine;N-(3-methylphenyl)-N-(6-phenyldibenzofuran-4-yl)-12-oxapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-amine;N-(4-methylphenyl)-N-(6-phenyldibenzofuran-4-yl)-12-oxapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-amine;N-(6-phenyldibenzofuran-4-yl)-N-(2-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-amine;N-(6-phenyldibenzofuran-4-yl)-N-(3-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-amine;N-(6-phenyldibenzofuran-4-yl)-N-(4-phenylphenyl)-12-oxapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-amine
CID 158461455
4-N,20-N-di(dibenzofuran-4-yl)-4-N,20-N-bis(2,5-dimethylphenyl)-12-thiapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;4-N,20-N-di(dibenzofuran-4-yl)-4-N,20-N-bis(2-phenylphenyl)-12-thiapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;4-N,20-N-di(dibenzofuran-4-yl)-4-N,20-N-bis(3-phenylphenyl)-12-thiapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;9-N,9-N,15-N,15-N-tetraphenyl-12-thiapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,15-diamine
CID 159147533
6-N,18-N-di(dibenzofuran-4-yl)-6-N,18-N-bis(4-fluorophenyl)-12-thiapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3(8),4,6,9,14,16(21),17,19-decaene-6,18-diamine;6-N,18-N-di(dibenzofuran-4-yl)-6-N-(4-methylphenyl)-18-N-(4-trimethylsilylphenyl)-12-thiapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3(8),4,6,9,14,16(21),17,19-decaene-6,18-diamine;6-N,18-N-diphenyl-6-N,18-N-bis(6-phenyldibenzofuran-4-yl)-12-thiapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3(8),4,6,9,14,16(21),17,19-decaene-6,18-diamine
CID 159109938
N-(4-fluorophenyl)-N-phenyl-12-thiapentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaen-9-amine;N-naphthalen-1-yl-N-phenyl-12-thiapentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaen-9-amine;N-naphthalen-2-yl-N-phenyl-12-thiapentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaen-9-amine;N-phenanthren-9-yl-N-phenyl-12-thiapentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaen-9-amine;N-phenyl-N-(3-phenylphenyl)-12-thiapentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaen-9-amine;N-phenyl-N-(4-phenylphenyl)-12-thiapentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaen-9-amine;N-phenyl-N-(4-trimethylsilylphenyl)-12-thiapentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaen-9-amine;4-[N-(12-thiapentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaen-9-yl)anilino]benzonitrile
CID 158841818
4-N,20-N-bis(6-tert-butyldibenzofuran-4-yl)-4-N,20-N-bis(2-methylphenyl)-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;4-N,20-N-bis(6-tert-butyldibenzofuran-4-yl)-4-N,20-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;4-N,20-N-bis(4-fluorophenyl)-4-N,20-N-bis(6-phenyldibenzofuran-4-yl)-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine;4-N-(4-methylphenyl)-4-N,20-N-bis(6-phenyldibenzofuran-4-yl)-20-N-(4-trimethylsilylphenyl)-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-4,20-diamine
CID 161454633
1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(2-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-1-yl)-1-N,6-N-diphenyl-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-diphenyl-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzothiophen-4-yl)-1-N,6-N-diphenyl-3,8-di(propan-2-yl)pyrene-1,6-diamine;4-(N-[6-(N-(4-isocyanophenyl)-4-methylanilino)-3,8-di(propan-2-yl)pyren-1-yl]-4-trimethylsilylanilino)benzonitrile
CID 158659673
6-phenyl-N-(3-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaen-9-yl)dibenzofuran-4-amine
CID 90263632
6-N,11-N-bis(2-methylphenyl)-6-N,11-N-bis(6-phenyldibenzofuran-4-yl)naphtho[3,2-b][1]benzofuran-6,11-diamine;6-N,11-N-bis(3-methylphenyl)-6-N,11-N-bis(6-phenyldibenzofuran-4-yl)naphtho[3,2-b][1]benzofuran-6,11-diamine;6-N,11-N-di(dibenzofuran-4-yl)-6-N-(4-methylphenyl)-11-N-(4-trimethylsilylphenyl)naphtho[3,2-b][1]benzofuran-6,11-diamine;6-N,11-N-diphenyl-6-N,11-N-bis(6-phenyldibenzofuran-4-yl)naphtho[3,2-b][1]benzofuran-6,11-diamine
CID 158281613
N-naphtho[1,2-b][1]benzothiol-5-yl-N-(2-phenylphenyl)dibenzofuran-4-amine
CID 90263491

Frequently Asked Questions

What is the IUPAC name of 4-[dibenzofuran-4-yl(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)amino]benzonitrile;N,6-diphenyl-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(4-fluorophenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(2-methylphenyl)-6-phenyl-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(2-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(3-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(4-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)-N-(4-trimethylsilylphenyl)dibenzofuran-4-amine?
The IUPAC name of 4-[dibenzofuran-4-yl(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)amino]benzonitrile;N,6-diphenyl-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(4-fluorophenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(2-methylphenyl)-6-phenyl-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(2-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(3-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(4-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)-N-(4-trimethylsilylphenyl)dibenzofuran-4-amine (CID 158985996) is 4-[dibenzofuran-4-yl(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)amino]benzonitrile;N,6-diphenyl-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(4-fluorophenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(2-methylphenyl)-6-phenyl-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(2-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(3-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(4-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)-N-(4-trimethylsilylphenyl)dibenzofuran-4-amine.
What is the SMILES notation for 4-[dibenzofuran-4-yl(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)amino]benzonitrile;N,6-diphenyl-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(4-fluorophenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(2-methylphenyl)-6-phenyl-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(2-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(3-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(4-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)-N-(4-trimethylsilylphenyl)dibenzofuran-4-amine?
The canonical SMILES for 4-[dibenzofuran-4-yl(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)amino]benzonitrile;N,6-diphenyl-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(4-fluorophenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(2-methylphenyl)-6-phenyl-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(2-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(3-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(4-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)-N-(4-trimethylsilylphenyl)dibenzofuran-4-amine is C[Si](C)(C)c1ccc(N(c2cc3c4cc5ccccc5cc4sc3c3ccccc23)c2cccc3c2oc2ccccc23)cc1.Cc1ccccc1N(c1cc2c3cc4ccccc4cc3sc2c2ccccc12)c1cccc2c1oc1c(-c3ccccc3)cccc12.Fc1ccc(N(c2cc3c4cc5ccccc5cc4sc3c3ccccc23)c2cccc3c2oc2ccccc23)cc1.N#Cc1ccc(N(c2cc3c4cc5ccccc5cc4sc3c3ccccc23)c2cccc3c2oc2ccccc23)cc1.c1ccc(-c2ccc(N(c3cc4c5cc6ccccc6cc5sc4c4ccccc34)c3cccc4c3oc3ccccc34)cc2)cc1.c1ccc(-c2cccc(N(c3cc4c5cc6ccccc6cc5sc4c4ccccc34)c3cccc4c3oc3ccccc34)c2)cc1.c1ccc(-c2cccc3c2oc2c(N(c4ccccc4)c4cc5c6cc7ccccc7cc6sc5c5ccccc45)cccc23)cc1.c1ccc(-c2ccccc2N(c2cc3c4cc5ccccc5cc4sc3c3ccccc23)c2cccc3c2oc2ccccc23)cc1.
What is the InChIKey of 4-[dibenzofuran-4-yl(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)amino]benzonitrile;N,6-diphenyl-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(4-fluorophenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(2-methylphenyl)-6-phenyl-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(2-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(3-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(4-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)-N-(4-trimethylsilylphenyl)dibenzofuran-4-amine?
The InChIKey is JPOPOQAJIXRIHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C45H29NOS.4C44H27NOS.C41H31NOSSi.C39H22N2OS.C38H22FNOS/c1-28-13-5-10-23-39(28)46(40-24-12-22-35-34-21-11-20-32(43(34)47-44(35)40)29-14-3-2-4-15-29)41-27-38-37-25-30-16-6-7-17-31(30)26-42(37)48-45(38)36-19-9-8-18-33(36)41;1-3-13-28(14-4-1)32-21-11-22-34-35-23-12-24-39(43(35)46-42(32)34)45(31-17-5-2-6-18-31)40-27-38-37-25-29-15-7-8-16-30(29)26-41(37)47-44(38)36-20-10-9-19-33(36)40;1-2-13-28(14-3-1)31-17-8-10-22-38(31)45(39-23-12-21-34-33-19-9-11-24-41(33)46-43(34)39)40-27-37-36-25-29-15-4-5-16-30(29)26-42(36)47-44(37)35-20-7-6-18-32(35)40;1-2-12-28(13-3-1)29-16-10-17-32(24-29)45(39-22-11-21-35-34-19-8-9-23-41(34)46-43(35)39)40-27-38-37-25-30-14-4-5-15-31(30)26-42(37)47-44(38)36-20-7-6-18-33(36)40;1-2-11-28(12-3-1)29-21-23-32(24-22-29)45(39-19-10-18-35-34-16-8-9-20-41(34)46-43(35)39)40-27-38-37-25-30-13-4-5-14-31(30)26-42(37)47-44(38)36-17-7-6-15-33(36)40;1-45(2,3)29-21-19-28(20-22-29)42(36-17-10-16-32-31-14-8-9-18-38(31)43-40(32)36)37-25-35-34-23-26-11-4-5-12-27(26)24-39(34)44-41(35)33-15-7-6-13-30(33)37;40-23-24-16-18-27(19-17-24)41(34-14-7-13-30-29-11-5-6-15-36(29)42-38(30)34)35-22-33-32-20-25-8-1-2-9-26(25)21-37(32)43-39(33)31-12-4-3-10-28(31)35;39-25-16-18-26(19-17-25)40(33-14-7-13-29-28-11-5-6-15-35(28)41-37(29)33)34-22-32-31-20-23-8-1-2-9-24(23)21-36(31)42-38(32)30-12-4-3-10-27(30)34/h2-27H,1H3;4*1-27H;4-25H,1-3H3;1-22H;1-22H.
What are the key properties of 4-[dibenzofuran-4-yl(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)amino]benzonitrile;N,6-diphenyl-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(4-fluorophenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(2-methylphenyl)-6-phenyl-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(2-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(3-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(4-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)-N-(4-trimethylsilylphenyl)dibenzofuran-4-amine?
4-[dibenzofuran-4-yl(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)amino]benzonitrile;N,6-diphenyl-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(4-fluorophenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(2-methylphenyl)-6-phenyl-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(2-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(3-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(4-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)-N-(4-trimethylsilylphenyl)dibenzofuran-4-amine has a molecular weight of 4843.10 g/mol, XLogP of 103.04, 30 rotatable bonds, 0 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[dibenzofuran-4-yl(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)amino]benzonitrile;N,6-diphenyl-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(4-fluorophenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(2-methylphenyl)-6-phenyl-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(2-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(3-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(4-phenylphenyl)-N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)dibenzofuran-4-amine;N-(12-thiapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaen-20-yl)-N-(4-trimethylsilylphenyl)dibenzofuran-4-amine is sourced from PubChem (CID 158985996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).