diphenyl-[9-(2-pyridin-2-yl-4-pyridinyl)carbazol-2-yl]phosphane

C34H24N3P — CID 177070986

IUPACdiphenyl-[9-(2-pyridin-2-yl-4-pyridinyl)carbazol-2-yl]phosphane
SMILESc1ccc(P(c2ccccc2)c2ccc3c4ccccc4n(-c4ccnc(-c5ccccn5)c4)c3c2)cc1
InChIInChI=1S/C34H24N3P/c1-3-11-26(12-4-1)38(27-13-5-2-6-14-27)28-18-19-30-29-15-7-8-17-33(29)37(34(30)24-28)25-20-22-36-32(23-25)31-16-9-10-21-35-31/h1-24H
InChIKeyIMXUSMGQIKNXJG-UHFFFAOYSA-N
MW505.56 g/mol
LogP7.00
Rot. Bonds5

About diphenyl-[9-(2-pyridin-2-yl-4-pyridinyl)carbazol-2-yl]phosphane

diphenyl-[9-(2-pyridin-2-yl-4-pyridinyl)carbazol-2-yl]phosphane (PubChem CID 177070986) has the molecular formula C34H24N3P and a molecular weight of 505.56 g/mol. Its IUPAC name is diphenyl-[9-(2-pyridin-2-yl-4-pyridinyl)carbazol-2-yl]phosphane.

Molecular Properties

Compound Namediphenyl-[9-(2-pyridin-2-yl-4-pyridinyl)carbazol-2-yl]phosphane
PubChem CID177070986
Molecular FormulaC34H24N3P
Molecular Weight505.56 g/mol
Exact Mass505.17
IUPAC Namediphenyl-[9-(2-pyridin-2-yl-4-pyridinyl)carbazol-2-yl]phosphane
SMILESc1ccc(P(c2ccccc2)c2ccc3c4ccccc4n(-c4ccnc(-c5ccccn5)c4)c3c2)cc1
InChIInChI=1S/C34H24N3P/c1-3-11-26(12-4-1)38(27-13-5-2-6-14-27)28-18-19-30-29-15-7-8-17-33(29)37(34(30)24-28)25-20-22-36-32(23-25)31-16-9-10-21-35-31/h1-24H
InChIKeyIMXUSMGQIKNXJG-UHFFFAOYSA-N
XLogP7.00
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms38
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500505.56
LogP ≤ 57.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze diphenyl-[9-(2-pyridin-2-yl-4-pyridinyl)carbazol-2-yl]phosphane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of diphenyl-[9-(2-pyridin-2-yl-4-pyridinyl)carbazol-2-yl]phosphane?
The IUPAC name of diphenyl-[9-(2-pyridin-2-yl-4-pyridinyl)carbazol-2-yl]phosphane (CID 177070986) is diphenyl-[9-(2-pyridin-2-yl-4-pyridinyl)carbazol-2-yl]phosphane.
What is the SMILES notation for diphenyl-[9-(2-pyridin-2-yl-4-pyridinyl)carbazol-2-yl]phosphane?
The canonical SMILES for diphenyl-[9-(2-pyridin-2-yl-4-pyridinyl)carbazol-2-yl]phosphane is c1ccc(P(c2ccccc2)c2ccc3c4ccccc4n(-c4ccnc(-c5ccccn5)c4)c3c2)cc1.
What is the InChIKey of diphenyl-[9-(2-pyridin-2-yl-4-pyridinyl)carbazol-2-yl]phosphane?
The InChIKey is IMXUSMGQIKNXJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H24N3P/c1-3-11-26(12-4-1)38(27-13-5-2-6-14-27)28-18-19-30-29-15-7-8-17-33(29)37(34(30)24-28)25-20-22-36-32(23-25)31-16-9-10-21-35-31/h1-24H.
What are the key properties of diphenyl-[9-(2-pyridin-2-yl-4-pyridinyl)carbazol-2-yl]phosphane?
diphenyl-[9-(2-pyridin-2-yl-4-pyridinyl)carbazol-2-yl]phosphane has a molecular weight of 505.56 g/mol, XLogP of 7.00, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for diphenyl-[9-(2-pyridin-2-yl-4-pyridinyl)carbazol-2-yl]phosphane is sourced from PubChem (CID 177070986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).