3-[9-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]carbazol-3-yl]-9-phenylpyrido[2,3-b]indole;3-(9-phenylcarbazol-3-yl)-9-(4-phenylquinazolin-2-yl)pyrido[2,3-b]indole

C93H59N11 — CID 161354836

IUPAC3-[9-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]carbazol-3-yl]-9-phenylpyrido[2,3-b]indole;3-(9-phenylcarbazol-3-yl)-9-(4-phenylquinazolin-2-yl)pyrido[2,3-b]indole
SMILESc1ccc(-c2nc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)cnc43)nc3ccccc23)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5cc(-c6ccccn6)nc(-c6ccccn6)c5)cc4)cnc32)cc1
InChIInChI=1S/C50H32N6.C43H27N5/c1-2-12-37(13-3-1)56-48-19-7-5-15-40(48)42-29-36(32-53-50(42)56)34-22-25-49-41(28-34)39-14-4-6-18-47(39)55(49)38-23-20-33(21-24-38)35-30-45(43-16-8-10-26-51-43)54-46(31-35)44-17-9-11-27-52-44;1-3-13-28(14-4-1)41-34-19-7-10-20-37(34)45-43(46-41)48-39-22-12-9-18-33(39)36-26-30(27-44-42(36)48)29-23-24-40-35(25-29)32-17-8-11-21-38(32)47(40)31-15-5-2-6-16-31/h1-32H;1-27H
InChIKeyVOKCPILSPHDGSV-UHFFFAOYSA-N
MW1330.57 g/mol
LogP22.68
Rot. Bonds10

About 3-[9-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]carbazol-3-yl]-9-phenylpyrido[2,3-b]indole;3-(9-phenylcarbazol-3-yl)-9-(4-phenylquinazolin-2-yl)pyrido[2,3-b]indole

3-[9-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]carbazol-3-yl]-9-phenylpyrido[2,3-b]indole;3-(9-phenylcarbazol-3-yl)-9-(4-phenylquinazolin-2-yl)pyrido[2,3-b]indole (PubChem CID 161354836) has the molecular formula C93H59N11 and a molecular weight of 1330.57 g/mol. Its IUPAC name is 3-[9-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]carbazol-3-yl]-9-phenylpyrido[2,3-b]indole;3-(9-phenylcarbazol-3-yl)-9-(4-phenylquinazolin-2-yl)pyrido[2,3-b]indole.

Molecular Properties

Compound Name3-[9-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]carbazol-3-yl]-9-phenylpyrido[2,3-b]indole;3-(9-phenylcarbazol-3-yl)-9-(4-phenylquinazolin-2-yl)pyrido[2,3-b]indole
PubChem CID161354836
Molecular FormulaC93H59N11
Molecular Weight1330.57 g/mol
Exact Mass1329.50
IUPAC Name3-[9-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]carbazol-3-yl]-9-phenylpyrido[2,3-b]indole;3-(9-phenylcarbazol-3-yl)-9-(4-phenylquinazolin-2-yl)pyrido[2,3-b]indole
SMILESc1ccc(-c2nc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)cnc43)nc3ccccc23)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5cc(-c6ccccn6)nc(-c6ccccn6)c5)cc4)cnc32)cc1
InChIInChI=1S/C50H32N6.C43H27N5/c1-2-12-37(13-3-1)56-48-19-7-5-15-40(48)42-29-36(32-53-50(42)56)34-22-25-49-41(28-34)39-14-4-6-18-47(39)55(49)38-23-20-33(21-24-38)35-30-45(43-16-8-10-26-51-43)54-46(31-35)44-17-9-11-27-52-44;1-3-13-28(14-4-1)41-34-19-7-10-20-37(34)45-43(46-41)48-39-22-12-9-18-33(39)36-26-30(27-44-42(36)48)29-23-24-40-35(25-29)32-17-8-11-21-38(32)47(40)31-15-5-2-6-16-31/h1-32H;1-27H
InChIKeyVOKCPILSPHDGSV-UHFFFAOYSA-N
XLogP22.68
TPSA109.95 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds10
Heavy Atoms104
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001330.57
LogP ≤ 522.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Analyze 3-[9-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]carbazol-3-yl]-9-phenylpyrido[2,3-b]indole;3-(9-phenylcarbazol-3-yl)-9-(4-phenylquinazolin-2-yl)pyrido[2,3-b]indole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-[9-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]carbazol-3-yl]-9-phenylpyrido[2,3-b]indole;3-(9-phenylcarbazol-3-yl)-9-(4-phenylquinazolin-2-yl)pyrido[2,3-b]indole?
The IUPAC name of 3-[9-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]carbazol-3-yl]-9-phenylpyrido[2,3-b]indole;3-(9-phenylcarbazol-3-yl)-9-(4-phenylquinazolin-2-yl)pyrido[2,3-b]indole (CID 161354836) is 3-[9-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]carbazol-3-yl]-9-phenylpyrido[2,3-b]indole;3-(9-phenylcarbazol-3-yl)-9-(4-phenylquinazolin-2-yl)pyrido[2,3-b]indole.
What is the SMILES notation for 3-[9-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]carbazol-3-yl]-9-phenylpyrido[2,3-b]indole;3-(9-phenylcarbazol-3-yl)-9-(4-phenylquinazolin-2-yl)pyrido[2,3-b]indole?
The canonical SMILES for 3-[9-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]carbazol-3-yl]-9-phenylpyrido[2,3-b]indole;3-(9-phenylcarbazol-3-yl)-9-(4-phenylquinazolin-2-yl)pyrido[2,3-b]indole is c1ccc(-c2nc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)cnc43)nc3ccccc23)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5cc(-c6ccccn6)nc(-c6ccccn6)c5)cc4)cnc32)cc1.
What is the InChIKey of 3-[9-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]carbazol-3-yl]-9-phenylpyrido[2,3-b]indole;3-(9-phenylcarbazol-3-yl)-9-(4-phenylquinazolin-2-yl)pyrido[2,3-b]indole?
The InChIKey is VOKCPILSPHDGSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H32N6.C43H27N5/c1-2-12-37(13-3-1)56-48-19-7-5-15-40(48)42-29-36(32-53-50(42)56)34-22-25-49-41(28-34)39-14-4-6-18-47(39)55(49)38-23-20-33(21-24-38)35-30-45(43-16-8-10-26-51-43)54-46(31-35)44-17-9-11-27-52-44;1-3-13-28(14-4-1)41-34-19-7-10-20-37(34)45-43(46-41)48-39-22-12-9-18-33(39)36-26-30(27-44-42(36)48)29-23-24-40-35(25-29)32-17-8-11-21-38(32)47(40)31-15-5-2-6-16-31/h1-32H;1-27H.
What are the key properties of 3-[9-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]carbazol-3-yl]-9-phenylpyrido[2,3-b]indole;3-(9-phenylcarbazol-3-yl)-9-(4-phenylquinazolin-2-yl)pyrido[2,3-b]indole?
3-[9-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]carbazol-3-yl]-9-phenylpyrido[2,3-b]indole;3-(9-phenylcarbazol-3-yl)-9-(4-phenylquinazolin-2-yl)pyrido[2,3-b]indole has a molecular weight of 1330.57 g/mol, XLogP of 22.68, 10 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[9-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]carbazol-3-yl]-9-phenylpyrido[2,3-b]indole;3-(9-phenylcarbazol-3-yl)-9-(4-phenylquinazolin-2-yl)pyrido[2,3-b]indole is sourced from PubChem (CID 161354836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).