14-[3-[2-dibenzofuran-2-yl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[3-[6-dibenzofuran-4-yl-2-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[3-(2-dibenzofuran-3-yl-6-phenylpyrimidin-4-yl)phenyl]-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene

C150H89N9O4S2 — CID 159262788

IUPAC14-[3-[2-dibenzofuran-2-yl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[3-[6-dibenzofuran-4-yl-2-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[3-(2-dibenzofuran-3-yl-6-phenylpyrimidin-4-yl)phenyl]-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
SMILESc1ccc(-c2cc(-c3cccc(-n4c5ccccc5c5c6c(ccc54)oc4ccccc46)c3)nc(-c3ccc4c(c3)oc3ccccc34)n2)cc1.c1ccc(-c2ccc(-c3nc(-c4cccc(-n5c6ccccc6c6c7c(ccc65)sc5ccccc57)c4)cc(-c4cccc5c4oc4ccccc45)n3)cc2)cc1.c1ccc(-c2cccc(-c3cc(-c4cccc(-n5c6ccccc6c6c7c(ccc65)sc5ccccc57)c4)nc(-c4ccc5oc6ccccc6c5c4)n3)c2)cc1
InChIInChI=1S/2C52H31N3OS.C46H27N3O2/c1-2-12-32(13-3-1)33-14-10-15-34(28-33)42-31-43(54-52(53-42)36-24-26-47-41(30-36)38-18-5-8-22-46(38)56-47)35-16-11-17-37(29-35)55-44-21-7-4-19-39(44)50-45(55)25-27-49-51(50)40-20-6-9-23-48(40)57-49;1-2-12-32(13-3-1)33-24-26-34(27-25-33)52-53-42(31-43(54-52)39-20-11-19-38-37-16-5-8-22-46(37)56-51(38)39)35-14-10-15-36(30-35)55-44-21-7-4-17-40(44)49-45(55)28-29-48-50(49)41-18-6-9-23-47(41)57-48;1-2-11-28(12-3-1)36-27-37(48-46(47-36)30-21-22-33-32-15-5-8-19-40(32)51-43(33)26-30)29-13-10-14-31(25-29)49-38-18-7-4-16-34(38)44-39(49)23-24-42-45(44)35-17-6-9-20-41(35)50-42/h2*1-31H;1-27H
InChIKeyKWSJCVYWUCKOIY-UHFFFAOYSA-N
MW2145.55 g/mol
LogP41.39
Rot. Bonds14

About 14-[3-[2-dibenzofuran-2-yl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[3-[6-dibenzofuran-4-yl-2-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[3-(2-dibenzofuran-3-yl-6-phenylpyrimidin-4-yl)phenyl]-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene

14-[3-[2-dibenzofuran-2-yl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[3-[6-dibenzofuran-4-yl-2-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[3-(2-dibenzofuran-3-yl-6-phenylpyrimidin-4-yl)phenyl]-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene (PubChem CID 159262788) has the molecular formula C150H89N9O4S2 and a molecular weight of 2145.55 g/mol. Its IUPAC name is 14-[3-[2-dibenzofuran-2-yl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[3-[6-dibenzofuran-4-yl-2-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[3-(2-dibenzofuran-3-yl-6-phenylpyrimidin-4-yl)phenyl]-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene.

Molecular Properties

Compound Name14-[3-[2-dibenzofuran-2-yl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[3-[6-dibenzofuran-4-yl-2-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[3-(2-dibenzofuran-3-yl-6-phenylpyrimidin-4-yl)phenyl]-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
PubChem CID159262788
Molecular FormulaC150H89N9O4S2
Molecular Weight2145.55 g/mol
Exact Mass2143.65
IUPAC Name14-[3-[2-dibenzofuran-2-yl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[3-[6-dibenzofuran-4-yl-2-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[3-(2-dibenzofuran-3-yl-6-phenylpyrimidin-4-yl)phenyl]-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
SMILESc1ccc(-c2cc(-c3cccc(-n4c5ccccc5c5c6c(ccc54)oc4ccccc46)c3)nc(-c3ccc4c(c3)oc3ccccc34)n2)cc1.c1ccc(-c2ccc(-c3nc(-c4cccc(-n5c6ccccc6c6c7c(ccc65)sc5ccccc57)c4)cc(-c4cccc5c4oc4ccccc45)n3)cc2)cc1.c1ccc(-c2cccc(-c3cc(-c4cccc(-n5c6ccccc6c6c7c(ccc65)sc5ccccc57)c4)nc(-c4ccc5oc6ccccc6c5c4)n3)c2)cc1
InChIInChI=1S/2C52H31N3OS.C46H27N3O2/c1-2-12-32(13-3-1)33-14-10-15-34(28-33)42-31-43(54-52(53-42)36-24-26-47-41(30-36)38-18-5-8-22-46(38)56-47)35-16-11-17-37(29-35)55-44-21-7-4-19-39(44)50-45(55)25-27-49-51(50)40-20-6-9-23-48(40)57-49;1-2-12-32(13-3-1)33-24-26-34(27-25-33)52-53-42(31-43(54-52)39-20-11-19-38-37-16-5-8-22-46(37)56-51(38)39)35-14-10-15-36(30-35)55-44-21-7-4-17-40(44)49-45(55)28-29-48-50(49)41-18-6-9-23-47(41)57-48;1-2-11-28(12-3-1)36-27-37(48-46(47-36)30-21-22-33-32-15-5-8-19-40(32)51-43(33)26-30)29-13-10-14-31(25-29)49-38-18-7-4-16-34(38)44-39(49)23-24-42-45(44)35-17-6-9-20-41(35)50-42/h2*1-31H;1-27H
InChIKeyKWSJCVYWUCKOIY-UHFFFAOYSA-N
XLogP41.39
TPSA144.69 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds14
Heavy Atoms165
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002145.55
LogP ≤ 541.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze 14-[3-[2-dibenzofuran-2-yl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[3-[6-dibenzofuran-4-yl-2-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[3-(2-dibenzofuran-3-yl-6-phenylpyrimidin-4-yl)phenyl]-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene with MolForge

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Related Compounds

14-[3-[4-dibenzothiophen-3-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[3-(4-dibenzothiophen-2-yl-6-phenylpyrimidin-2-yl)phenyl]-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[3-(4-dibenzothiophen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 158441101
12-[4-(4-dibenzofuran-2-yl-6-dibenzothiophen-2-ylpyrimidin-2-yl)phenyl]-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12-[4-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12-[4-[4-naphthalen-2-yl-6-(9-phenylcarbazol-3-yl)pyrimidin-2-yl]phenyl]-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene
CID 157067778
14-[4-[2-dibenzothiophen-4-yl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[4-[6-dibenzothiophen-4-yl-2-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-[4-(2-dibenzothiophen-4-yl-6-phenyl-4-pyridinyl)phenyl]-[1]benzofuro[3,2-c]carbazole;5-[4-(2-dibenzothiophen-4-yl-6-phenyl-4-pyridinyl)phenyl]-[1]benzothiolo[3,2-c]carbazole;14-[4-(6-dibenzothiophen-4-yl-2-phenylpyrimidin-4-yl)phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 159310143
9-[4-dibenzofuran-3-yl-6-(3-phenylphenyl)pyrimidin-2-yl]-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-[4-dibenzofuran-4-yl-6-(3-phenylphenyl)pyrimidin-2-yl]-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 158667209
3-[8-[9-(6-dibenzofuran-3-yl-2-phenylpyrimidin-4-yl)dibenzofuran-2-yl]dibenzothiophen-1-yl]-9-phenylcarbazole
CID 168768597
11-[2-dibenzofuran-3-yl-6-(4-phenylphenyl)pyrimidin-4-yl]-5-phenyl-[1]benzofuro[3,2-c]carbazole;11-[4-dibenzofuran-3-yl-6-(3-phenylphenyl)pyrimidin-2-yl]-5-phenyl-[1]benzofuro[3,2-c]carbazole;11-(2,6-diphenyl-4-pyridinyl)-5-(4-phenylphenyl)-[1]benzofuro[3,2-c]carbazole;11-(4,6-diphenyl-2-pyridinyl)-5-(3-phenylphenyl)-[1]benzofuro[3,2-c]carbazole;methane
CID 158075368
10-[4-dibenzothiophen-2-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenyl-[1]benzofuro[3,2-c]carbazole;10-[4-dibenzothiophen-2-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenyl-[1]benzofuro[3,2-c]carbazole
CID 163782384
14-[3-(6-dibenzothiophen-2-yl-4-phenyl-2-pyridinyl)phenyl]-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 118154562
5-[3-(4-dibenzothiophen-4-yl-6-phenylpyrimidin-2-yl)phenyl]-[1]benzofuro[3,2-c]carbazole
CID 118154691
3-dibenzofuran-3-yl-6-(9-phenylcarbazol-3-yl)-9-(3-phenylphenyl)carbazole;3-dibenzofuran-4-yl-6-(9-phenylcarbazol-3-yl)-9-(3-phenylphenyl)carbazole;3-dibenzothiophen-1-yl-6-(9-phenylcarbazol-3-yl)-9-(3-phenylphenyl)carbazole;3-dibenzothiophen-2-yl-6-(9-phenylcarbazol-3-yl)-9-(3-phenylphenyl)carbazole
CID 159897890
9-[3-(4-dibenzofuran-3-yl-6-phenylpyrimidin-2-yl)phenyl]-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 169014621
12-[4-(4-dibenzofuran-2-yl-6-dibenzothiophen-2-yl-2-pyridinyl)phenyl]-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12-[4-[2-dibenzofuran-4-yl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12-[4-[6-naphthalen-2-yl-2-(9-phenylcarbazol-3-yl)pyrimidin-4-yl]phenyl]-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene
CID 162135148

Frequently Asked Questions

What is the IUPAC name of 14-[3-[2-dibenzofuran-2-yl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[3-[6-dibenzofuran-4-yl-2-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[3-(2-dibenzofuran-3-yl-6-phenylpyrimidin-4-yl)phenyl]-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene?
The IUPAC name of 14-[3-[2-dibenzofuran-2-yl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[3-[6-dibenzofuran-4-yl-2-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[3-(2-dibenzofuran-3-yl-6-phenylpyrimidin-4-yl)phenyl]-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene (CID 159262788) is 14-[3-[2-dibenzofuran-2-yl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[3-[6-dibenzofuran-4-yl-2-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[3-(2-dibenzofuran-3-yl-6-phenylpyrimidin-4-yl)phenyl]-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene.
What is the SMILES notation for 14-[3-[2-dibenzofuran-2-yl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[3-[6-dibenzofuran-4-yl-2-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[3-(2-dibenzofuran-3-yl-6-phenylpyrimidin-4-yl)phenyl]-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene?
The canonical SMILES for 14-[3-[2-dibenzofuran-2-yl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[3-[6-dibenzofuran-4-yl-2-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[3-(2-dibenzofuran-3-yl-6-phenylpyrimidin-4-yl)phenyl]-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene is c1ccc(-c2cc(-c3cccc(-n4c5ccccc5c5c6c(ccc54)oc4ccccc46)c3)nc(-c3ccc4c(c3)oc3ccccc34)n2)cc1.c1ccc(-c2ccc(-c3nc(-c4cccc(-n5c6ccccc6c6c7c(ccc65)sc5ccccc57)c4)cc(-c4cccc5c4oc4ccccc45)n3)cc2)cc1.c1ccc(-c2cccc(-c3cc(-c4cccc(-n5c6ccccc6c6c7c(ccc65)sc5ccccc57)c4)nc(-c4ccc5oc6ccccc6c5c4)n3)c2)cc1.
What is the InChIKey of 14-[3-[2-dibenzofuran-2-yl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[3-[6-dibenzofuran-4-yl-2-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[3-(2-dibenzofuran-3-yl-6-phenylpyrimidin-4-yl)phenyl]-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene?
The InChIKey is KWSJCVYWUCKOIY-UHFFFAOYSA-N. The full InChI is InChI=1S/2C52H31N3OS.C46H27N3O2/c1-2-12-32(13-3-1)33-14-10-15-34(28-33)42-31-43(54-52(53-42)36-24-26-47-41(30-36)38-18-5-8-22-46(38)56-47)35-16-11-17-37(29-35)55-44-21-7-4-19-39(44)50-45(55)25-27-49-51(50)40-20-6-9-23-48(40)57-49;1-2-12-32(13-3-1)33-24-26-34(27-25-33)52-53-42(31-43(54-52)39-20-11-19-38-37-16-5-8-22-46(37)56-51(38)39)35-14-10-15-36(30-35)55-44-21-7-4-17-40(44)49-45(55)28-29-48-50(49)41-18-6-9-23-47(41)57-48;1-2-11-28(12-3-1)36-27-37(48-46(47-36)30-21-22-33-32-15-5-8-19-40(32)51-43(33)26-30)29-13-10-14-31(25-29)49-38-18-7-4-16-34(38)44-39(49)23-24-42-45(44)35-17-6-9-20-41(35)50-42/h2*1-31H;1-27H.
What are the key properties of 14-[3-[2-dibenzofuran-2-yl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[3-[6-dibenzofuran-4-yl-2-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[3-(2-dibenzofuran-3-yl-6-phenylpyrimidin-4-yl)phenyl]-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene?
14-[3-[2-dibenzofuran-2-yl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[3-[6-dibenzofuran-4-yl-2-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[3-(2-dibenzofuran-3-yl-6-phenylpyrimidin-4-yl)phenyl]-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene has a molecular weight of 2145.55 g/mol, XLogP of 41.39, 14 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 14-[3-[2-dibenzofuran-2-yl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[3-[6-dibenzofuran-4-yl-2-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[3-(2-dibenzofuran-3-yl-6-phenylpyrimidin-4-yl)phenyl]-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene is sourced from PubChem (CID 159262788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).