5-phenyl-9-(9-phenylcarbazol-2-yl)pyrido[3,2-b]indole

C35H23N3 — CID 118587992

IUPAC5-phenyl-9-(9-phenylcarbazol-2-yl)pyrido[3,2-b]indole
SMILESc1ccc(-n2c3ccccc3c3ccc(-c4cccc5c4c4ncccc4n5-c4ccccc4)cc32)cc1
InChIInChI=1S/C35H23N3/c1-3-11-25(12-4-1)37-30-17-8-7-15-28(30)29-21-20-24(23-33(29)37)27-16-9-18-31-34(27)35-32(19-10-22-36-35)38(31)26-13-5-2-6-14-26/h1-23H
InChIKeyAZVLBIFGWPGLSM-UHFFFAOYSA-N
MW485.59 g/mol
LogP8.94
Rot. Bonds3

About 5-phenyl-9-(9-phenylcarbazol-2-yl)pyrido[3,2-b]indole

5-phenyl-9-(9-phenylcarbazol-2-yl)pyrido[3,2-b]indole (PubChem CID 118587992) has the molecular formula C35H23N3 and a molecular weight of 485.59 g/mol. Its IUPAC name is 5-phenyl-9-(9-phenylcarbazol-2-yl)pyrido[3,2-b]indole.

Molecular Properties

Compound Name5-phenyl-9-(9-phenylcarbazol-2-yl)pyrido[3,2-b]indole
PubChem CID118587992
Molecular FormulaC35H23N3
Molecular Weight485.59 g/mol
Exact Mass485.19
IUPAC Name5-phenyl-9-(9-phenylcarbazol-2-yl)pyrido[3,2-b]indole
SMILESc1ccc(-n2c3ccccc3c3ccc(-c4cccc5c4c4ncccc4n5-c4ccccc4)cc32)cc1
InChIInChI=1S/C35H23N3/c1-3-11-25(12-4-1)37-30-17-8-7-15-28(30)29-21-20-24(23-33(29)37)27-16-9-18-31-34(27)35-32(19-10-22-36-35)38(31)26-13-5-2-6-14-26/h1-23H
InChIKeyAZVLBIFGWPGLSM-UHFFFAOYSA-N
XLogP8.94
TPSA22.75 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms38
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500485.59
LogP ≤ 58.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-phenyl-9-(9-phenylcarbazol-2-yl)pyrido[3,2-b]indole?
The IUPAC name of 5-phenyl-9-(9-phenylcarbazol-2-yl)pyrido[3,2-b]indole (CID 118587992) is 5-phenyl-9-(9-phenylcarbazol-2-yl)pyrido[3,2-b]indole.
What is the SMILES notation for 5-phenyl-9-(9-phenylcarbazol-2-yl)pyrido[3,2-b]indole?
The canonical SMILES for 5-phenyl-9-(9-phenylcarbazol-2-yl)pyrido[3,2-b]indole is c1ccc(-n2c3ccccc3c3ccc(-c4cccc5c4c4ncccc4n5-c4ccccc4)cc32)cc1.
What is the InChIKey of 5-phenyl-9-(9-phenylcarbazol-2-yl)pyrido[3,2-b]indole?
The InChIKey is AZVLBIFGWPGLSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H23N3/c1-3-11-25(12-4-1)37-30-17-8-7-15-28(30)29-21-20-24(23-33(29)37)27-16-9-18-31-34(27)35-32(19-10-22-36-35)38(31)26-13-5-2-6-14-26/h1-23H.
What are the key properties of 5-phenyl-9-(9-phenylcarbazol-2-yl)pyrido[3,2-b]indole?
5-phenyl-9-(9-phenylcarbazol-2-yl)pyrido[3,2-b]indole has a molecular weight of 485.59 g/mol, XLogP of 8.94, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-9-(9-phenylcarbazol-2-yl)pyrido[3,2-b]indole is sourced from PubChem (CID 118587992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).