9H-carbazole;[2-(9H-carbazol-1-yl)phenyl]-phenylmethanone

C37H26N2O — CID 175398027

IUPAC9H-carbazole;[2-(9H-carbazol-1-yl)phenyl]-phenylmethanone
SMILESO=C(c1ccccc1)c1ccccc1-c1cccc2c1[nH]c1ccccc12.c1ccc2c(c1)[nH]c1ccccc12
InChIInChI=1S/C25H17NO.C12H9N/c27-25(17-9-2-1-3-10-17)22-13-5-4-11-18(22)20-14-8-15-21-19-12-6-7-16-23(19)26-24(20)21;1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11/h1-16,26H;1-8,13H
InChIKeyHZOOJNFPXASYSU-UHFFFAOYSA-N
MW514.63 g/mol
LogP9.54
Rot. Bonds3

About 9H-carbazole;[2-(9H-carbazol-1-yl)phenyl]-phenylmethanone

9H-carbazole;[2-(9H-carbazol-1-yl)phenyl]-phenylmethanone (PubChem CID 175398027) has the molecular formula C37H26N2O and a molecular weight of 514.63 g/mol. Its IUPAC name is 9H-carbazole;[2-(9H-carbazol-1-yl)phenyl]-phenylmethanone.

Molecular Properties

Compound Name9H-carbazole;[2-(9H-carbazol-1-yl)phenyl]-phenylmethanone
PubChem CID175398027
Molecular FormulaC37H26N2O
Molecular Weight514.63 g/mol
Exact Mass514.20
IUPAC Name9H-carbazole;[2-(9H-carbazol-1-yl)phenyl]-phenylmethanone
SMILESO=C(c1ccccc1)c1ccccc1-c1cccc2c1[nH]c1ccccc12.c1ccc2c(c1)[nH]c1ccccc12
InChIInChI=1S/C25H17NO.C12H9N/c27-25(17-9-2-1-3-10-17)22-13-5-4-11-18(22)20-14-8-15-21-19-12-6-7-16-23(19)26-24(20)21;1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11/h1-16,26H;1-8,13H
InChIKeyHZOOJNFPXASYSU-UHFFFAOYSA-N
XLogP9.54
TPSA48.65 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500514.63
LogP ≤ 59.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

1-[2-(9H-carbazol-1-yl)phenyl]-9H-carbazole
CID 66618059
2-(9H-carbazole-1-carbonyl)benzoic acid
CID 54401477
1-[4-[1-[4-(9H-carbazol-1-yl)phenyl]-2,2-diphenylethenyl]phenyl]-9H-carbazole
CID 155666000
9H-carbazole;phenyl-[2-(2-phenylethenyl)phenyl]methanone
CID 162206940
(2-amino-9H-carbazol-1-yl)-phenylmethanone
CID 154352677
benzoic acid;9H-carbazole
CID 162147282
(2-methyl-9H-pyrido[3,4-b]indol-2-ium-1-yl)-phenylmethanone iodide
CID 127040471
9H-carbazole;carbonic acid
CID 67577328
9H-carbazole-1-carboxamide;hydrochloride
CID 141272518
1-[4-[4-[4-[4-(9H-carbazol-1-yl)phenyl]phenyl]phenyl]phenyl]-9H-carbazole
CID 175958773
N-(9H-carbazol-1-yl)benzamide
CID 138533611
[2-(9H-carbazol-1-yl)phenyl]boronic acid
CID 66887079

Frequently Asked Questions

What is the IUPAC name of 9H-carbazole;[2-(9H-carbazol-1-yl)phenyl]-phenylmethanone?
The IUPAC name of 9H-carbazole;[2-(9H-carbazol-1-yl)phenyl]-phenylmethanone (CID 175398027) is 9H-carbazole;[2-(9H-carbazol-1-yl)phenyl]-phenylmethanone.
What is the SMILES notation for 9H-carbazole;[2-(9H-carbazol-1-yl)phenyl]-phenylmethanone?
The canonical SMILES for 9H-carbazole;[2-(9H-carbazol-1-yl)phenyl]-phenylmethanone is O=C(c1ccccc1)c1ccccc1-c1cccc2c1[nH]c1ccccc12.c1ccc2c(c1)[nH]c1ccccc12.
What is the InChIKey of 9H-carbazole;[2-(9H-carbazol-1-yl)phenyl]-phenylmethanone?
The InChIKey is HZOOJNFPXASYSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H17NO.C12H9N/c27-25(17-9-2-1-3-10-17)22-13-5-4-11-18(22)20-14-8-15-21-19-12-6-7-16-23(19)26-24(20)21;1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11/h1-16,26H;1-8,13H.
What are the key properties of 9H-carbazole;[2-(9H-carbazol-1-yl)phenyl]-phenylmethanone?
9H-carbazole;[2-(9H-carbazol-1-yl)phenyl]-phenylmethanone has a molecular weight of 514.63 g/mol, XLogP of 9.54, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9H-carbazole;[2-(9H-carbazol-1-yl)phenyl]-phenylmethanone is sourced from PubChem (CID 175398027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).