(5-oxobenzo[b]phosphindol-5-yl)-phenylmethanone

C19H13O2P — CID 54223358

IUPAC(5-oxobenzo[b]phosphindol-5-yl)-phenylmethanone
SMILESO=C(c1ccccc1)P1(=O)c2ccccc2-c2ccccc21
InChIInChI=1S/C19H13O2P/c20-19(14-8-2-1-3-9-14)22(21)17-12-6-4-10-15(17)16-11-5-7-13-18(16)22/h1-13H
InChIKeyQEDTYYZDPYTFMR-UHFFFAOYSA-N
MW304.29 g/mol
LogP3.82
Rot. Bonds2

About (5-oxobenzo[b]phosphindol-5-yl)-phenylmethanone

(5-oxobenzo[b]phosphindol-5-yl)-phenylmethanone (PubChem CID 54223358) has the molecular formula C19H13O2P and a molecular weight of 304.29 g/mol. Its IUPAC name is (5-oxobenzo[b]phosphindol-5-yl)-phenylmethanone.

Molecular Properties

Compound Name(5-oxobenzo[b]phosphindol-5-yl)-phenylmethanone
PubChem CID54223358
Molecular FormulaC19H13O2P
Molecular Weight304.29 g/mol
Exact Mass304.07
IUPAC Name(5-oxobenzo[b]phosphindol-5-yl)-phenylmethanone
SMILESO=C(c1ccccc1)P1(=O)c2ccccc2-c2ccccc21
InChIInChI=1S/C19H13O2P/c20-19(14-8-2-1-3-9-14)22(21)17-12-6-4-10-15(17)16-11-5-7-13-18(16)22/h1-13H
InChIKeyQEDTYYZDPYTFMR-UHFFFAOYSA-N
XLogP3.82
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.29
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (5-oxobenzo[b]phosphindol-5-yl)-phenylmethanone?
The IUPAC name of (5-oxobenzo[b]phosphindol-5-yl)-phenylmethanone (CID 54223358) is (5-oxobenzo[b]phosphindol-5-yl)-phenylmethanone.
What is the SMILES notation for (5-oxobenzo[b]phosphindol-5-yl)-phenylmethanone?
The canonical SMILES for (5-oxobenzo[b]phosphindol-5-yl)-phenylmethanone is O=C(c1ccccc1)P1(=O)c2ccccc2-c2ccccc21.
What is the InChIKey of (5-oxobenzo[b]phosphindol-5-yl)-phenylmethanone?
The InChIKey is QEDTYYZDPYTFMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13O2P/c20-19(14-8-2-1-3-9-14)22(21)17-12-6-4-10-15(17)16-11-5-7-13-18(16)22/h1-13H.
What are the key properties of (5-oxobenzo[b]phosphindol-5-yl)-phenylmethanone?
(5-oxobenzo[b]phosphindol-5-yl)-phenylmethanone has a molecular weight of 304.29 g/mol, XLogP of 3.82, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-oxobenzo[b]phosphindol-5-yl)-phenylmethanone is sourced from PubChem (CID 54223358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).