3-phenyl-9-(2-phenylpyrimidin-5-yl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(4-pyridin-2-ylphenyl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(6-pyridin-3-yl-2-pyridinyl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(2-pyridin-3-ylpyrimidin-4-yl)pyrrolo[3,2-b]carbazole

C120H80N16 — CID 159630059

IUPAC3-phenyl-9-(2-phenylpyrimidin-5-yl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(4-pyridin-2-ylphenyl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(6-pyridin-3-yl-2-pyridinyl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(2-pyridin-3-ylpyrimidin-4-yl)pyrrolo[3,2-b]carbazole
SMILESc1ccc(-c2ncc(-n3c4ccccc4c4cc5c(ccn5-c5ccccc5)cc43)cn2)cc1.c1ccc(-n2ccc3cc4c(cc32)c2ccccc2n4-c2ccc(-c3ccccn3)cc2)cc1.c1ccc(-n2ccc3cc4c(cc32)c2ccccc2n4-c2cccc(-c3cccnc3)n2)cc1.c1ccc(-n2ccc3cc4c(cc32)c2ccccc2n4-c2ccnc(-c3cccnc3)n2)cc1
InChIInChI=1S/C31H21N3.2C30H20N4.C29H19N5/c1-2-8-24(9-3-1)33-19-17-23-20-31-27(21-30(23)33)26-10-4-5-12-29(26)34(31)25-15-13-22(14-16-25)28-11-6-7-18-32-28;1-3-9-21(10-4-1)30-31-19-24(20-32-30)34-27-14-8-7-13-25(27)26-18-28-22(17-29(26)34)15-16-33(28)23-11-5-2-6-12-23;1-2-9-23(10-3-1)33-17-15-21-18-29-25(19-28(21)33)24-11-4-5-13-27(24)34(29)30-14-6-12-26(32-30)22-8-7-16-31-20-22;1-2-8-22(9-3-1)33-16-13-20-17-27-24(18-26(20)33)23-10-4-5-11-25(23)34(27)28-12-15-31-29(32-28)21-7-6-14-30-19-21/h1-21H;2*1-20H;1-19H
InChIKeyMOZRCFWUAGQEJL-UHFFFAOYSA-N
MW1746.07 g/mol
LogP28.74
Rot. Bonds12

About 3-phenyl-9-(2-phenylpyrimidin-5-yl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(4-pyridin-2-ylphenyl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(6-pyridin-3-yl-2-pyridinyl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(2-pyridin-3-ylpyrimidin-4-yl)pyrrolo[3,2-b]carbazole

3-phenyl-9-(2-phenylpyrimidin-5-yl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(4-pyridin-2-ylphenyl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(6-pyridin-3-yl-2-pyridinyl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(2-pyridin-3-ylpyrimidin-4-yl)pyrrolo[3,2-b]carbazole (PubChem CID 159630059) has the molecular formula C120H80N16 and a molecular weight of 1746.07 g/mol. Its IUPAC name is 3-phenyl-9-(2-phenylpyrimidin-5-yl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(4-pyridin-2-ylphenyl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(6-pyridin-3-yl-2-pyridinyl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(2-pyridin-3-ylpyrimidin-4-yl)pyrrolo[3,2-b]carbazole.

Molecular Properties

Compound Name3-phenyl-9-(2-phenylpyrimidin-5-yl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(4-pyridin-2-ylphenyl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(6-pyridin-3-yl-2-pyridinyl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(2-pyridin-3-ylpyrimidin-4-yl)pyrrolo[3,2-b]carbazole
PubChem CID159630059
Molecular FormulaC120H80N16
Molecular Weight1746.07 g/mol
Exact Mass1744.68
IUPAC Name3-phenyl-9-(2-phenylpyrimidin-5-yl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(4-pyridin-2-ylphenyl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(6-pyridin-3-yl-2-pyridinyl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(2-pyridin-3-ylpyrimidin-4-yl)pyrrolo[3,2-b]carbazole
SMILESc1ccc(-c2ncc(-n3c4ccccc4c4cc5c(ccn5-c5ccccc5)cc43)cn2)cc1.c1ccc(-n2ccc3cc4c(cc32)c2ccccc2n4-c2ccc(-c3ccccn3)cc2)cc1.c1ccc(-n2ccc3cc4c(cc32)c2ccccc2n4-c2cccc(-c3cccnc3)n2)cc1.c1ccc(-n2ccc3cc4c(cc32)c2ccccc2n4-c2ccnc(-c3cccnc3)n2)cc1
InChIInChI=1S/C31H21N3.2C30H20N4.C29H19N5/c1-2-8-24(9-3-1)33-19-17-23-20-31-27(21-30(23)33)26-10-4-5-12-29(26)34(31)25-15-13-22(14-16-25)28-11-6-7-18-32-28;1-3-9-21(10-4-1)30-31-19-24(20-32-30)34-27-14-8-7-13-25(27)26-18-28-22(17-29(26)34)15-16-33(28)23-11-5-2-6-12-23;1-2-9-23(10-3-1)33-17-15-21-18-29-25(19-28(21)33)24-11-4-5-13-27(24)34(29)30-14-6-12-26(32-30)22-8-7-16-31-20-22;1-2-8-22(9-3-1)33-16-13-20-17-27-24(18-26(20)33)23-10-4-5-11-25(23)34(27)28-12-15-31-29(32-28)21-7-6-14-30-19-21/h1-21H;2*1-20H;1-19H
InChIKeyMOZRCFWUAGQEJL-UHFFFAOYSA-N
XLogP28.74
TPSA142.56 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds12
Heavy Atoms136
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001746.07
LogP ≤ 528.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Analyze 3-phenyl-9-(2-phenylpyrimidin-5-yl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(4-pyridin-2-ylphenyl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(6-pyridin-3-yl-2-pyridinyl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(2-pyridin-3-ylpyrimidin-4-yl)pyrrolo[3,2-b]carbazole with MolForge

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Related Compounds

18-phenyl-10-(2-phenylpyrimidin-4-yl)-10,18-diazapentacyclo[11.7.0.03,11.04,9.015,19]icosa-1,3(11),4,6,8,12,14,16,19-nonaene
CID 90222807
10,19-diphenyl-23-(3-pyridin-2-ylphenyl)-10,19,23-triazahexacyclo[11.10.0.03,11.04,9.014,22.016,20]tricosa-1(13),2,4,6,8,11,14(22),15,17,20-decaene
CID 90267588
14,18-diphenyl-3-(6-pyridin-3-yl-2-pyridinyl)-3,14,18-triazahexacyclo[11.10.0.02,10.04,9.015,23.017,21]tricosa-1(13),2(10),4,6,8,11,15(23),16,19,21-decaene
CID 90267193
20-phenyl-14-(6-pyridin-3-yl-2-pyridinyl)-10-thia-14,20-diazahexacyclo[11.10.0.03,11.04,9.015,23.017,21]tricosa-1(13),2,4,6,8,11,15(23),16,18,21-decaene
CID 90267109
7-phenyl-14-(2-pyridin-3-ylpyrimidin-5-yl)-7,14-diazapentacyclo[11.7.0.03,11.04,8.015,20]icosa-1(13),2,4(8),5,9,11,15,17,19-nonaene
CID 90223583
16-phenyl-10-(4-pyridin-3-yl-2-pyridinyl)-10,16-diazapentacyclo[11.7.0.03,11.04,9.015,19]icosa-1,3(11),4,6,8,12,14,17,19-nonaene
CID 90223541
5-phenyl-11-(6-phenyl-2-pyridinyl)indolo[3,2-b]carbazole
CID 58570053
1-(4,6-diphenyl-2-pyridinyl)-9-(4-pyridin-2-ylphenyl)pyrrolo[2,3-b]carbazole
CID 123499530
23-(2,6-dipyridin-3-yl-4-pyridinyl)-23-azahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17,19,21-dodecaene;23-(5-phenylpyrazin-2-yl)-23-azahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17,19,21-dodecaene;23-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-23-azahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17,19,21-dodecaene;23-(2-phenylpyrimidin-5-yl)-23-azahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17,19,21-dodecaene
CID 159644664
5-(6-phenyl-2-pyridinyl)-11-(6-pyridin-2-yl-2-pyridinyl)indolo[3,2-b]carbazole
CID 118504611
7-(4-phenylphenyl)-5-(6-pyridin-2-yl-2-pyridinyl)indolo[2,3-b]carbazole
CID 129254521
3-phenyl-9-(3-pyrido[4,3-d]pyrimidin-2-ylphenyl)pyrrolo[3,2-b]carbazole
CID 118317283

Frequently Asked Questions

What is the IUPAC name of 3-phenyl-9-(2-phenylpyrimidin-5-yl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(4-pyridin-2-ylphenyl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(6-pyridin-3-yl-2-pyridinyl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(2-pyridin-3-ylpyrimidin-4-yl)pyrrolo[3,2-b]carbazole?
The IUPAC name of 3-phenyl-9-(2-phenylpyrimidin-5-yl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(4-pyridin-2-ylphenyl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(6-pyridin-3-yl-2-pyridinyl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(2-pyridin-3-ylpyrimidin-4-yl)pyrrolo[3,2-b]carbazole (CID 159630059) is 3-phenyl-9-(2-phenylpyrimidin-5-yl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(4-pyridin-2-ylphenyl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(6-pyridin-3-yl-2-pyridinyl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(2-pyridin-3-ylpyrimidin-4-yl)pyrrolo[3,2-b]carbazole.
What is the SMILES notation for 3-phenyl-9-(2-phenylpyrimidin-5-yl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(4-pyridin-2-ylphenyl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(6-pyridin-3-yl-2-pyridinyl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(2-pyridin-3-ylpyrimidin-4-yl)pyrrolo[3,2-b]carbazole?
The canonical SMILES for 3-phenyl-9-(2-phenylpyrimidin-5-yl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(4-pyridin-2-ylphenyl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(6-pyridin-3-yl-2-pyridinyl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(2-pyridin-3-ylpyrimidin-4-yl)pyrrolo[3,2-b]carbazole is c1ccc(-c2ncc(-n3c4ccccc4c4cc5c(ccn5-c5ccccc5)cc43)cn2)cc1.c1ccc(-n2ccc3cc4c(cc32)c2ccccc2n4-c2ccc(-c3ccccn3)cc2)cc1.c1ccc(-n2ccc3cc4c(cc32)c2ccccc2n4-c2cccc(-c3cccnc3)n2)cc1.c1ccc(-n2ccc3cc4c(cc32)c2ccccc2n4-c2ccnc(-c3cccnc3)n2)cc1.
What is the InChIKey of 3-phenyl-9-(2-phenylpyrimidin-5-yl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(4-pyridin-2-ylphenyl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(6-pyridin-3-yl-2-pyridinyl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(2-pyridin-3-ylpyrimidin-4-yl)pyrrolo[3,2-b]carbazole?
The InChIKey is MOZRCFWUAGQEJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H21N3.2C30H20N4.C29H19N5/c1-2-8-24(9-3-1)33-19-17-23-20-31-27(21-30(23)33)26-10-4-5-12-29(26)34(31)25-15-13-22(14-16-25)28-11-6-7-18-32-28;1-3-9-21(10-4-1)30-31-19-24(20-32-30)34-27-14-8-7-13-25(27)26-18-28-22(17-29(26)34)15-16-33(28)23-11-5-2-6-12-23;1-2-9-23(10-3-1)33-17-15-21-18-29-25(19-28(21)33)24-11-4-5-13-27(24)34(29)30-14-6-12-26(32-30)22-8-7-16-31-20-22;1-2-8-22(9-3-1)33-16-13-20-17-27-24(18-26(20)33)23-10-4-5-11-25(23)34(27)28-12-15-31-29(32-28)21-7-6-14-30-19-21/h1-21H;2*1-20H;1-19H.
What are the key properties of 3-phenyl-9-(2-phenylpyrimidin-5-yl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(4-pyridin-2-ylphenyl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(6-pyridin-3-yl-2-pyridinyl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(2-pyridin-3-ylpyrimidin-4-yl)pyrrolo[3,2-b]carbazole?
3-phenyl-9-(2-phenylpyrimidin-5-yl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(4-pyridin-2-ylphenyl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(6-pyridin-3-yl-2-pyridinyl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(2-pyridin-3-ylpyrimidin-4-yl)pyrrolo[3,2-b]carbazole has a molecular weight of 1746.07 g/mol, XLogP of 28.74, 12 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-9-(2-phenylpyrimidin-5-yl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(4-pyridin-2-ylphenyl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(6-pyridin-3-yl-2-pyridinyl)pyrrolo[3,2-b]carbazole;3-phenyl-9-(2-pyridin-3-ylpyrimidin-4-yl)pyrrolo[3,2-b]carbazole is sourced from PubChem (CID 159630059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).