diphenylphosphinothioyl(phenyl)methanone

C19H15OPS — CID 54293875

IUPACdiphenylphosphinothioyl(phenyl)methanone
SMILESO=C(c1ccccc1)P(=S)(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H15OPS/c20-19(16-10-4-1-5-11-16)21(22,17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15H
InChIKeyRZKRDYUKRZFQLK-UHFFFAOYSA-N
MW322.37 g/mol
LogP3.96
Rot. Bonds4

About diphenylphosphinothioyl(phenyl)methanone

diphenylphosphinothioyl(phenyl)methanone (PubChem CID 54293875) has the molecular formula C19H15OPS and a molecular weight of 322.37 g/mol. Its IUPAC name is diphenylphosphinothioyl(phenyl)methanone.

Molecular Properties

Compound Namediphenylphosphinothioyl(phenyl)methanone
PubChem CID54293875
Molecular FormulaC19H15OPS
Molecular Weight322.37 g/mol
Exact Mass322.06
IUPAC Namediphenylphosphinothioyl(phenyl)methanone
SMILESO=C(c1ccccc1)P(=S)(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H15OPS/c20-19(16-10-4-1-5-11-16)21(22,17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15H
InChIKeyRZKRDYUKRZFQLK-UHFFFAOYSA-N
XLogP3.96
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.37
LogP ≤ 53.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

diphenylmethanone
CID 3102
S-diphenylphosphinothioyl benzenecarbothioate
CID 10861163
[(E)-2-diphenylphosphinothioyl-1-phenylethenyl]-diphenyl-sulfanylidene-λ5-phosphane
CID 11706501
diphenylmethanone;gold
CID 174931146
bis(diphenylmethanone);dihydrochloride
CID 69107757
disodium;diphenylmethanone
CID 19380838
cobalt(2+);diphenylmethanone
CID 19033779
magnesium [4-[oxido(phenyl)phosphoryl]carbonylbenzoyl]-phenylphosphinate
CID 178174318
bis(1,2-diphenylethane-1,2-dione);hydrogen peroxide
CID 18415505
diphenylmethanone;ethane
CID 158014879
bromo-diphenyl-sulfanylidene-λ5-phosphane
CID 23415811
diphenylmethanone;hydron;fluoride
CID 21465824

Frequently Asked Questions

What is the IUPAC name of diphenylphosphinothioyl(phenyl)methanone?
The IUPAC name of diphenylphosphinothioyl(phenyl)methanone (CID 54293875) is diphenylphosphinothioyl(phenyl)methanone.
What is the SMILES notation for diphenylphosphinothioyl(phenyl)methanone?
The canonical SMILES for diphenylphosphinothioyl(phenyl)methanone is O=C(c1ccccc1)P(=S)(c1ccccc1)c1ccccc1.
What is the InChIKey of diphenylphosphinothioyl(phenyl)methanone?
The InChIKey is RZKRDYUKRZFQLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15OPS/c20-19(16-10-4-1-5-11-16)21(22,17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15H.
What are the key properties of diphenylphosphinothioyl(phenyl)methanone?
diphenylphosphinothioyl(phenyl)methanone has a molecular weight of 322.37 g/mol, XLogP of 3.96, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diphenylphosphinothioyl(phenyl)methanone is sourced from PubChem (CID 54293875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).