9-(9-naphthalen-2-ylcarbazol-4-yl)-5-phenylpyrido[3,2-b]indole;5-phenyl-9-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole

C74H48N6 — CID 158495534

IUPAC9-(9-naphthalen-2-ylcarbazol-4-yl)-5-phenylpyrido[3,2-b]indole;5-phenyl-9-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole
SMILESc1ccc(-n2c3ccccc3c3c(-c4cccc5c4c4ncccc4n5-c4ccccc4)cccc32)cc1.c1ccc(-n2c3cccnc3c3c(-c4cccc5c4c4ccccc4n5-c4ccc5ccccc5c4)cccc32)cc1
InChIInChI=1S/C39H25N3.C35H23N3/c1-2-13-28(14-3-1)41-35-20-9-17-31(38(35)39-36(41)21-10-24-40-39)30-16-8-19-34-37(30)32-15-6-7-18-33(32)42(34)29-23-22-26-11-4-5-12-27(26)25-29;1-3-12-24(13-4-1)37-29-19-8-7-16-28(29)33-26(17-9-20-30(33)37)27-18-10-21-31-34(27)35-32(22-11-23-36-35)38(31)25-14-5-2-6-15-25/h1-25H;1-23H
InChIKeyHJFWXEZANDOANR-UHFFFAOYSA-N
MW1021.24 g/mol
LogP19.04
Rot. Bonds6

About 9-(9-naphthalen-2-ylcarbazol-4-yl)-5-phenylpyrido[3,2-b]indole;5-phenyl-9-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole

9-(9-naphthalen-2-ylcarbazol-4-yl)-5-phenylpyrido[3,2-b]indole;5-phenyl-9-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole (PubChem CID 158495534) has the molecular formula C74H48N6 and a molecular weight of 1021.24 g/mol. Its IUPAC name is 9-(9-naphthalen-2-ylcarbazol-4-yl)-5-phenylpyrido[3,2-b]indole;5-phenyl-9-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole.

Molecular Properties

Compound Name9-(9-naphthalen-2-ylcarbazol-4-yl)-5-phenylpyrido[3,2-b]indole;5-phenyl-9-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole
PubChem CID158495534
Molecular FormulaC74H48N6
Molecular Weight1021.24 g/mol
Exact Mass1020.39
IUPAC Name9-(9-naphthalen-2-ylcarbazol-4-yl)-5-phenylpyrido[3,2-b]indole;5-phenyl-9-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole
SMILESc1ccc(-n2c3ccccc3c3c(-c4cccc5c4c4ncccc4n5-c4ccccc4)cccc32)cc1.c1ccc(-n2c3cccnc3c3c(-c4cccc5c4c4ccccc4n5-c4ccc5ccccc5c4)cccc32)cc1
InChIInChI=1S/C39H25N3.C35H23N3/c1-2-13-28(14-3-1)41-35-20-9-17-31(38(35)39-36(41)21-10-24-40-39)30-16-8-19-34-37(30)32-15-6-7-18-33(32)42(34)29-23-22-26-11-4-5-12-27(26)25-29;1-3-12-24(13-4-1)37-29-19-8-7-16-28(29)33-26(17-9-20-30(33)37)27-18-10-21-31-34(27)35-32(22-11-23-36-35)38(31)25-14-5-2-6-15-25/h1-25H;1-23H
InChIKeyHJFWXEZANDOANR-UHFFFAOYSA-N
XLogP19.04
TPSA45.50 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms80
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001021.24
LogP ≤ 519.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

9-(9-naphthalen-2-ylcarbazol-1-yl)-5-phenylpyrido[3,2-b]indole
CID 129221541
4-(9-naphthalen-2-ylcarbazol-4-yl)-9-phenylcarbazole
CID 134507252
9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-2-yl]-5-phenylpyrido[3,2-b]indole;9-(9-naphthalen-2-ylcarbazol-2-yl)-5-phenylpyrido[3,2-b]indole;5-phenyl-9-[9-(4-phenylphenyl)carbazol-2-yl]pyrido[3,2-b]indole
CID 158468921
9-[3-(3-carbazol-9-ylphenyl)phenyl]-14-phenyl-4,9,14-triazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene
CID 146973645
5-phenyl-9-(9-phenylcarbazol-2-yl)pyrido[3,2-b]indole
CID 118587992
24-fluoranthen-8-yl-9-naphthalen-2-yl-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene
CID 164836905
4-(9-naphthalen-2-ylcarbazol-4-yl)-9-(3-phenylphenyl)carbazole;4-(9-naphthalen-2-ylcarbazol-4-yl)-9-(4-phenylphenyl)carbazole;9-naphthalen-2-yl-4-(9-naphthalen-2-ylcarbazol-4-yl)carbazole;tetradeca-1,3,5,7,9,11,13-heptayne
CID 165014614
8-[9-[3-(2,6-diphenyl-4-pyridinyl)phenyl]carbazol-4-yl]-5-phenylpyrido[3,2-b]indole
CID 129221860
9,23-bis(4-phenylphenyl)-4,9,18,23-tetrazaoctacyclo[13.13.2.02,10.03,8.012,29.016,24.017,22.026,30]triaconta-1(29),2(10),3(8),4,6,11,13,15(30),16(24),17(22),18,20,25,27-tetradecaene;9,23-dinaphthalen-2-yl-4,9,18,23-tetrazaoctacyclo[13.13.2.02,10.03,8.012,29.016,24.017,22.026,30]triaconta-1(29),2(10),3(8),4,6,11,13,15(30),16(24),17(22),18,20,25,27-tetradecaene
CID 159698714
7-(9-naphthalen-2-ylcarbazol-4-yl)-9-phenylpyrido[3,4-b]indole
CID 118587041
5-(9-naphthalen-2-ylcarbazol-2-yl)-9-phenylpyrido[3,4-b]indole
CID 118587169
9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-naphthalen-2-ylcarbazol-2-yl]pyrido[2,3-b]indole
CID 156577735

Frequently Asked Questions

What is the IUPAC name of 9-(9-naphthalen-2-ylcarbazol-4-yl)-5-phenylpyrido[3,2-b]indole;5-phenyl-9-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole?
The IUPAC name of 9-(9-naphthalen-2-ylcarbazol-4-yl)-5-phenylpyrido[3,2-b]indole;5-phenyl-9-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole (CID 158495534) is 9-(9-naphthalen-2-ylcarbazol-4-yl)-5-phenylpyrido[3,2-b]indole;5-phenyl-9-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole.
What is the SMILES notation for 9-(9-naphthalen-2-ylcarbazol-4-yl)-5-phenylpyrido[3,2-b]indole;5-phenyl-9-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole?
The canonical SMILES for 9-(9-naphthalen-2-ylcarbazol-4-yl)-5-phenylpyrido[3,2-b]indole;5-phenyl-9-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole is c1ccc(-n2c3ccccc3c3c(-c4cccc5c4c4ncccc4n5-c4ccccc4)cccc32)cc1.c1ccc(-n2c3cccnc3c3c(-c4cccc5c4c4ccccc4n5-c4ccc5ccccc5c4)cccc32)cc1.
What is the InChIKey of 9-(9-naphthalen-2-ylcarbazol-4-yl)-5-phenylpyrido[3,2-b]indole;5-phenyl-9-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole?
The InChIKey is HJFWXEZANDOANR-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H25N3.C35H23N3/c1-2-13-28(14-3-1)41-35-20-9-17-31(38(35)39-36(41)21-10-24-40-39)30-16-8-19-34-37(30)32-15-6-7-18-33(32)42(34)29-23-22-26-11-4-5-12-27(26)25-29;1-3-12-24(13-4-1)37-29-19-8-7-16-28(29)33-26(17-9-20-30(33)37)27-18-10-21-31-34(27)35-32(22-11-23-36-35)38(31)25-14-5-2-6-15-25/h1-25H;1-23H.
What are the key properties of 9-(9-naphthalen-2-ylcarbazol-4-yl)-5-phenylpyrido[3,2-b]indole;5-phenyl-9-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole?
9-(9-naphthalen-2-ylcarbazol-4-yl)-5-phenylpyrido[3,2-b]indole;5-phenyl-9-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole has a molecular weight of 1021.24 g/mol, XLogP of 19.04, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(9-naphthalen-2-ylcarbazol-4-yl)-5-phenylpyrido[3,2-b]indole;5-phenyl-9-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole is sourced from PubChem (CID 158495534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).