2,4-diphenyl-6-[3-(20,20,21,21-tetramethyl-10-thiapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1(13),2,4,6,8,11,14(19),15,17-nonaen-16-yl)phenyl]-1,3,5-triazine;N-phenyl-N-(14,14,15,15-tetramethyl-3-thiapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,16(21),17,19-nonaen-18-yl)dibenzofuran-3-amine;14,14,15,15-tetramethyl-N,N-diphenyl-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,16(21),17,19-nonaen-18-amine;9-[4-(14,14,15,15-tetramethyl-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,16(21),17,19-nonaen-18-yl)phenyl]carbazole

C165H132N6OS4 — CID 163436080

IUPAC2,4-diphenyl-6-[3-(20,20,21,21-tetramethyl-10-thiapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1(13),2,4,6,8,11,14(19),15,17-nonaen-16-yl)phenyl]-1,3,5-triazine;N-phenyl-N-(14,14,15,15-tetramethyl-3-thiapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,16(21),17,19-nonaen-18-yl)dibenzofuran-3-amine;14,14,15,15-tetramethyl-N,N-diphenyl-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,16(21),17,19-nonaen-18-amine;9-[4-(14,14,15,15-tetramethyl-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,16(21),17,19-nonaen-18-yl)phenyl]carbazole
SMILESCC1(C)c2cc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)ccc2-c2c(ccc3sc4ccccc4c23)C1(C)C.CC1(C)c2cc(N(c3ccccc3)c3ccc4c(c3)oc3ccccc34)ccc2-c2c(ccc3c2sc2ccccc23)C1(C)C.CC1(C)c2cc(N(c3ccccc3)c3ccccc3)ccc2-c2c(ccc3sc4ccccc4c23)C1(C)C.CC1(C)c2ccc(-c3cccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3)cc2-c2cc3sc4ccccc4c3cc2C1(C)C
InChIInChI=1S/C45H35N3S.C42H33NOS.C42H33NS.C36H31NS/c1-44(2)37-23-22-31(25-34(37)35-27-40-36(26-38(35)45(44,3)4)33-20-11-12-21-39(33)49-40)30-18-13-19-32(24-30)43-47-41(28-14-7-5-8-15-28)46-42(48-43)29-16-9-6-10-17-29;1-41(2)34-23-22-32-31-15-9-11-17-38(31)45-40(32)39(34)33-21-19-27(24-35(33)42(41,3)4)43(26-12-6-5-7-13-26)28-18-20-30-29-14-8-10-16-36(29)44-37(30)25-28;1-41(2)33-23-24-38-40(32-13-7-10-16-37(32)44-38)39(33)31-22-19-27(25-34(31)42(41,3)4)26-17-20-28(21-18-26)43-35-14-8-5-11-29(35)30-12-6-9-15-36(30)43;1-35(2)29-21-22-32-34(28-17-11-12-18-31(28)38-32)33(29)27-20-19-26(23-30(27)36(35,3)4)37(24-13-7-5-8-14-24)25-15-9-6-10-16-25/h5-27H,1-4H3;5-25H,1-4H3;5-25H,1-4H3;5-23H,1-4H3
InChIKeyAUPMPSDKGGRXSU-UHFFFAOYSA-N
MW2343.18 g/mol
LogP47.62
Rot. Bonds12

About 2,4-diphenyl-6-[3-(20,20,21,21-tetramethyl-10-thiapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1(13),2,4,6,8,11,14(19),15,17-nonaen-16-yl)phenyl]-1,3,5-triazine;N-phenyl-N-(14,14,15,15-tetramethyl-3-thiapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,16(21),17,19-nonaen-18-yl)dibenzofuran-3-amine;14,14,15,15-tetramethyl-N,N-diphenyl-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,16(21),17,19-nonaen-18-amine;9-[4-(14,14,15,15-tetramethyl-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,16(21),17,19-nonaen-18-yl)phenyl]carbazole

2,4-diphenyl-6-[3-(20,20,21,21-tetramethyl-10-thiapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1(13),2,4,6,8,11,14(19),15,17-nonaen-16-yl)phenyl]-1,3,5-triazine;N-phenyl-N-(14,14,15,15-tetramethyl-3-thiapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,16(21),17,19-nonaen-18-yl)dibenzofuran-3-amine;14,14,15,15-tetramethyl-N,N-diphenyl-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,16(21),17,19-nonaen-18-amine;9-[4-(14,14,15,15-tetramethyl-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,16(21),17,19-nonaen-18-yl)phenyl]carbazole (PubChem CID 163436080) has the molecular formula C165H132N6OS4 and a molecular weight of 2343.18 g/mol. Its IUPAC name is 2,4-diphenyl-6-[3-(20,20,21,21-tetramethyl-10-thiapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1(13),2,4,6,8,11,14(19),15,17-nonaen-16-yl)phenyl]-1,3,5-triazine;N-phenyl-N-(14,14,15,15-tetramethyl-3-thiapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,16(21),17,19-nonaen-18-yl)dibenzofuran-3-amine;14,14,15,15-tetramethyl-N,N-diphenyl-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,16(21),17,19-nonaen-18-amine;9-[4-(14,14,15,15-tetramethyl-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,16(21),17,19-nonaen-18-yl)phenyl]carbazole.

Molecular Properties

Compound Name2,4-diphenyl-6-[3-(20,20,21,21-tetramethyl-10-thiapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1(13),2,4,6,8,11,14(19),15,17-nonaen-16-yl)phenyl]-1,3,5-triazine;N-phenyl-N-(14,14,15,15-tetramethyl-3-thiapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,16(21),17,19-nonaen-18-yl)dibenzofuran-3-amine;14,14,15,15-tetramethyl-N,N-diphenyl-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,16(21),17,19-nonaen-18-amine;9-[4-(14,14,15,15-tetramethyl-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,16(21),17,19-nonaen-18-yl)phenyl]carbazole
PubChem CID163436080
Molecular FormulaC165H132N6OS4
Molecular Weight2343.18 g/mol
Exact Mass2340.93
IUPAC Name2,4-diphenyl-6-[3-(20,20,21,21-tetramethyl-10-thiapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1(13),2,4,6,8,11,14(19),15,17-nonaen-16-yl)phenyl]-1,3,5-triazine;N-phenyl-N-(14,14,15,15-tetramethyl-3-thiapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,16(21),17,19-nonaen-18-yl)dibenzofuran-3-amine;14,14,15,15-tetramethyl-N,N-diphenyl-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,16(21),17,19-nonaen-18-amine;9-[4-(14,14,15,15-tetramethyl-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,16(21),17,19-nonaen-18-yl)phenyl]carbazole
SMILESCC1(C)c2cc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)ccc2-c2c(ccc3sc4ccccc4c23)C1(C)C.CC1(C)c2cc(N(c3ccccc3)c3ccc4c(c3)oc3ccccc34)ccc2-c2c(ccc3c2sc2ccccc23)C1(C)C.CC1(C)c2cc(N(c3ccccc3)c3ccccc3)ccc2-c2c(ccc3sc4ccccc4c23)C1(C)C.CC1(C)c2ccc(-c3cccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3)cc2-c2cc3sc4ccccc4c3cc2C1(C)C
InChIInChI=1S/C45H35N3S.C42H33NOS.C42H33NS.C36H31NS/c1-44(2)37-23-22-31(25-34(37)35-27-40-36(26-38(35)45(44,3)4)33-20-11-12-21-39(33)49-40)30-18-13-19-32(24-30)43-47-41(28-14-7-5-8-15-28)46-42(48-43)29-16-9-6-10-17-29;1-41(2)34-23-22-32-31-15-9-11-17-38(31)45-40(32)39(34)33-21-19-27(24-35(33)42(41,3)4)43(26-12-6-5-7-13-26)28-18-20-30-29-14-8-10-16-36(29)44-37(30)25-28;1-41(2)33-23-24-38-40(32-13-7-10-16-37(32)44-38)39(33)31-22-19-27(25-34(31)42(41,3)4)26-17-20-28(21-18-26)43-35-14-8-5-11-29(35)30-12-6-9-15-36(30)43;1-35(2)29-21-22-32-34(28-17-11-12-18-31(28)38-32)33(29)27-20-19-26(23-30(27)36(35,3)4)37(24-13-7-5-8-14-24)25-15-9-6-10-16-25/h5-27H,1-4H3;5-25H,1-4H3;5-25H,1-4H3;5-23H,1-4H3
InChIKeyAUPMPSDKGGRXSU-UHFFFAOYSA-N
XLogP47.62
TPSA63.22 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds12
Heavy Atoms176
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002343.18
LogP ≤ 547.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Analyze 2,4-diphenyl-6-[3-(20,20,21,21-tetramethyl-10-thiapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1(13),2,4,6,8,11,14(19),15,17-nonaen-16-yl)phenyl]-1,3,5-triazine;N-phenyl-N-(14,14,15,15-tetramethyl-3-thiapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,16(21),17,19-nonaen-18-yl)dibenzofuran-3-amine;14,14,15,15-tetramethyl-N,N-diphenyl-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,16(21),17,19-nonaen-18-amine;9-[4-(14,14,15,15-tetramethyl-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,16(21),17,19-nonaen-18-yl)phenyl]carbazole with MolForge

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Related Compounds

14,14,15,15-tetramethyl-N,N-diphenyl-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3(8),4,6,11,16,18,20-nonaen-5-amine;9-[4-(12,12,13,13-tetramethylphenanthro[1,2-b][1]benzothiol-8-yl)phenyl]carbazole;9-(14,14,15,15-tetramethyl-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3(8),4,6,11,16,18,20-nonaen-5-yl)carbazole
CID 163424763
9-[4-(14,14,15,15-tetramethyl-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,16(21),17,19-nonaen-18-yl)phenyl]carbazole
CID 163436082
9-[4-(7,7-dimethylfluoreno[5,6-b][1]benzothiol-9-yl)phenyl]-3,6-diphenylcarbazole;9-[4-(11,11-dimethylfluoreno[3,2-b][1]benzothiol-9-yl)phenyl]-3,6-diphenylcarbazole;9-[4-(12,12-dimethylfluoreno[2,1-b][1]benzothiol-10-yl)phenyl]-3,6-diphenylcarbazole;9-[4-(14,14-dimethyl-9-thiapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15(20),16,18-nonaen-17-yl)phenyl]-3,6-diphenylcarbazole
CID 161365898
N-[3-(4-carbazol-9-ylphenyl)phenyl]-N-dibenzothiophen-3-yldibenzofuran-3-amine
CID 147244332
2-dibenzofuran-1-yl-4-phenyl-6-(14,14,15,15-tetramethyl-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,16(21),17,19-nonaen-18-yl)-1,3,5-triazine
CID 163546422
3-[7-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-3-yl]-9-phenylcarbazole;3-[7-(4-dibenzothiophen-3-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-1-yl]-9-phenylcarbazole;3-[7-(4-dibenzothiophen-3-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]-9-phenylcarbazole;3-[7-(4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]-9-phenylcarbazole
CID 159076977
N-(4-dibenzofuran-4-ylphenyl)-N-phenyl-4-(9-phenylcarbazol-3-yl)aniline;3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazole;N-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-2-amine;N-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-4-amine;N-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzothiophen-2-amine;N-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzothiophen-4-amine
CID 160591901
N-phenyl-N-[8-(9-phenylcarbazol-3-yl)dibenzothiophen-3-yl]dibenzofuran-3-amine
CID 129180955
2,4-diphenyl-6-(14,14,15,15-tetramethyl-3-oxapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4(9),5,7,11,16,18,20-nonaen-5-yl)-1,3,5-triazine;14,14,15,15-tetramethyl-N,N-diphenyl-10-oxapentacyclo[11.8.0.03,11.04,9.016,21]henicosa-1(13),2,4(9),5,7,11,16,18,20-nonaen-6-amine;9-[4-(14,14,15,15-tetramethyl-3-oxapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4(9),5,7,11,16,18,20-nonaen-5-yl)phenyl]carbazole
CID 163647965
N-(9,9-dimethylfluoren-2-yl)-21,21,22,22-tetramethyl-N-phenylpentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15(20),16,18-decaen-18-amine;2,4-diphenyl-6-[3-(9,9,10,10-tetramethyl-6-pentacyclo[12.8.0.02,11.03,8.017,22]docosa-1(14),2(11),3(8),4,6,12,15,17,19,21-decaenyl)phenyl]-1,3,5-triazine;9-[4-(21,21,22,22-tetramethyl-18-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15(20),16,18-decaenyl)phenyl]carbazole
CID 163931712
2-dibenzothiophen-2-yl-4-phenyl-6-[9,9,10,10-tetramethyl-6-(3-phenylphenyl)phenanthren-2-yl]-1,3,5-triazine
CID 163454993
N-dibenzofuran-3-yl-4-dibenzothiophen-2-yl-N-(9,9-dimethylfluoren-4-yl)-6-(9-phenylcarbazol-2-yl)-1,3,5-triazin-2-amine
CID 171726933

Frequently Asked Questions

What is the IUPAC name of 2,4-diphenyl-6-[3-(20,20,21,21-tetramethyl-10-thiapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1(13),2,4,6,8,11,14(19),15,17-nonaen-16-yl)phenyl]-1,3,5-triazine;N-phenyl-N-(14,14,15,15-tetramethyl-3-thiapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,16(21),17,19-nonaen-18-yl)dibenzofuran-3-amine;14,14,15,15-tetramethyl-N,N-diphenyl-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,16(21),17,19-nonaen-18-amine;9-[4-(14,14,15,15-tetramethyl-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,16(21),17,19-nonaen-18-yl)phenyl]carbazole?
The IUPAC name of 2,4-diphenyl-6-[3-(20,20,21,21-tetramethyl-10-thiapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1(13),2,4,6,8,11,14(19),15,17-nonaen-16-yl)phenyl]-1,3,5-triazine;N-phenyl-N-(14,14,15,15-tetramethyl-3-thiapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,16(21),17,19-nonaen-18-yl)dibenzofuran-3-amine;14,14,15,15-tetramethyl-N,N-diphenyl-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,16(21),17,19-nonaen-18-amine;9-[4-(14,14,15,15-tetramethyl-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,16(21),17,19-nonaen-18-yl)phenyl]carbazole (CID 163436080) is 2,4-diphenyl-6-[3-(20,20,21,21-tetramethyl-10-thiapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1(13),2,4,6,8,11,14(19),15,17-nonaen-16-yl)phenyl]-1,3,5-triazine;N-phenyl-N-(14,14,15,15-tetramethyl-3-thiapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,16(21),17,19-nonaen-18-yl)dibenzofuran-3-amine;14,14,15,15-tetramethyl-N,N-diphenyl-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,16(21),17,19-nonaen-18-amine;9-[4-(14,14,15,15-tetramethyl-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,16(21),17,19-nonaen-18-yl)phenyl]carbazole.
What is the SMILES notation for 2,4-diphenyl-6-[3-(20,20,21,21-tetramethyl-10-thiapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1(13),2,4,6,8,11,14(19),15,17-nonaen-16-yl)phenyl]-1,3,5-triazine;N-phenyl-N-(14,14,15,15-tetramethyl-3-thiapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,16(21),17,19-nonaen-18-yl)dibenzofuran-3-amine;14,14,15,15-tetramethyl-N,N-diphenyl-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,16(21),17,19-nonaen-18-amine;9-[4-(14,14,15,15-tetramethyl-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,16(21),17,19-nonaen-18-yl)phenyl]carbazole?
The canonical SMILES for 2,4-diphenyl-6-[3-(20,20,21,21-tetramethyl-10-thiapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1(13),2,4,6,8,11,14(19),15,17-nonaen-16-yl)phenyl]-1,3,5-triazine;N-phenyl-N-(14,14,15,15-tetramethyl-3-thiapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,16(21),17,19-nonaen-18-yl)dibenzofuran-3-amine;14,14,15,15-tetramethyl-N,N-diphenyl-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,16(21),17,19-nonaen-18-amine;9-[4-(14,14,15,15-tetramethyl-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,16(21),17,19-nonaen-18-yl)phenyl]carbazole is CC1(C)c2cc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)ccc2-c2c(ccc3sc4ccccc4c23)C1(C)C.CC1(C)c2cc(N(c3ccccc3)c3ccc4c(c3)oc3ccccc34)ccc2-c2c(ccc3c2sc2ccccc23)C1(C)C.CC1(C)c2cc(N(c3ccccc3)c3ccccc3)ccc2-c2c(ccc3sc4ccccc4c23)C1(C)C.CC1(C)c2ccc(-c3cccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3)cc2-c2cc3sc4ccccc4c3cc2C1(C)C.
What is the InChIKey of 2,4-diphenyl-6-[3-(20,20,21,21-tetramethyl-10-thiapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1(13),2,4,6,8,11,14(19),15,17-nonaen-16-yl)phenyl]-1,3,5-triazine;N-phenyl-N-(14,14,15,15-tetramethyl-3-thiapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,16(21),17,19-nonaen-18-yl)dibenzofuran-3-amine;14,14,15,15-tetramethyl-N,N-diphenyl-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,16(21),17,19-nonaen-18-amine;9-[4-(14,14,15,15-tetramethyl-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,16(21),17,19-nonaen-18-yl)phenyl]carbazole?
The InChIKey is AUPMPSDKGGRXSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C45H35N3S.C42H33NOS.C42H33NS.C36H31NS/c1-44(2)37-23-22-31(25-34(37)35-27-40-36(26-38(35)45(44,3)4)33-20-11-12-21-39(33)49-40)30-18-13-19-32(24-30)43-47-41(28-14-7-5-8-15-28)46-42(48-43)29-16-9-6-10-17-29;1-41(2)34-23-22-32-31-15-9-11-17-38(31)45-40(32)39(34)33-21-19-27(24-35(33)42(41,3)4)43(26-12-6-5-7-13-26)28-18-20-30-29-14-8-10-16-36(29)44-37(30)25-28;1-41(2)33-23-24-38-40(32-13-7-10-16-37(32)44-38)39(33)31-22-19-27(25-34(31)42(41,3)4)26-17-20-28(21-18-26)43-35-14-8-5-11-29(35)30-12-6-9-15-36(30)43;1-35(2)29-21-22-32-34(28-17-11-12-18-31(28)38-32)33(29)27-20-19-26(23-30(27)36(35,3)4)37(24-13-7-5-8-14-24)25-15-9-6-10-16-25/h5-27H,1-4H3;5-25H,1-4H3;5-25H,1-4H3;5-23H,1-4H3.
What are the key properties of 2,4-diphenyl-6-[3-(20,20,21,21-tetramethyl-10-thiapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1(13),2,4,6,8,11,14(19),15,17-nonaen-16-yl)phenyl]-1,3,5-triazine;N-phenyl-N-(14,14,15,15-tetramethyl-3-thiapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,16(21),17,19-nonaen-18-yl)dibenzofuran-3-amine;14,14,15,15-tetramethyl-N,N-diphenyl-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,16(21),17,19-nonaen-18-amine;9-[4-(14,14,15,15-tetramethyl-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,16(21),17,19-nonaen-18-yl)phenyl]carbazole?
2,4-diphenyl-6-[3-(20,20,21,21-tetramethyl-10-thiapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1(13),2,4,6,8,11,14(19),15,17-nonaen-16-yl)phenyl]-1,3,5-triazine;N-phenyl-N-(14,14,15,15-tetramethyl-3-thiapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,16(21),17,19-nonaen-18-yl)dibenzofuran-3-amine;14,14,15,15-tetramethyl-N,N-diphenyl-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,16(21),17,19-nonaen-18-amine;9-[4-(14,14,15,15-tetramethyl-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,16(21),17,19-nonaen-18-yl)phenyl]carbazole has a molecular weight of 2343.18 g/mol, XLogP of 47.62, 12 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-diphenyl-6-[3-(20,20,21,21-tetramethyl-10-thiapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1(13),2,4,6,8,11,14(19),15,17-nonaen-16-yl)phenyl]-1,3,5-triazine;N-phenyl-N-(14,14,15,15-tetramethyl-3-thiapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,16(21),17,19-nonaen-18-yl)dibenzofuran-3-amine;14,14,15,15-tetramethyl-N,N-diphenyl-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,16(21),17,19-nonaen-18-amine;9-[4-(14,14,15,15-tetramethyl-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,16(21),17,19-nonaen-18-yl)phenyl]carbazole is sourced from PubChem (CID 163436080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).