diphenylphosphinothioylimino-methoxy-diphenyl-λ5-phosphane

C25H23NOP2S — CID 23418380

IUPACdiphenylphosphinothioylimino-methoxy-diphenyl-λ5-phosphane
SMILESCOP(=NP(=S)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H23NOP2S/c1-27-28(22-14-6-2-7-15-22,23-16-8-3-9-17-23)26-29(30,24-18-10-4-11-19-24)25-20-12-5-13-21-25/h2-21H,1H3
InChIKeyZAUDCNVAAROJLH-UHFFFAOYSA-N
MW447.48 g/mol
LogP5.45
Rot. Bonds6

About diphenylphosphinothioylimino-methoxy-diphenyl-λ5-phosphane

diphenylphosphinothioylimino-methoxy-diphenyl-λ5-phosphane (PubChem CID 23418380) has the molecular formula C25H23NOP2S and a molecular weight of 447.48 g/mol. Its IUPAC name is diphenylphosphinothioylimino-methoxy-diphenyl-λ5-phosphane.

Molecular Properties

Compound Namediphenylphosphinothioylimino-methoxy-diphenyl-λ5-phosphane
PubChem CID23418380
Molecular FormulaC25H23NOP2S
Molecular Weight447.48 g/mol
Exact Mass447.10
IUPAC Namediphenylphosphinothioylimino-methoxy-diphenyl-λ5-phosphane
SMILESCOP(=NP(=S)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H23NOP2S/c1-27-28(22-14-6-2-7-15-22,23-16-8-3-9-17-23)26-29(30,24-18-10-4-11-19-24)25-20-12-5-13-21-25/h2-21H,1H3
InChIKeyZAUDCNVAAROJLH-UHFFFAOYSA-N
XLogP5.45
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500447.48
LogP ≤ 55.45
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

methoxy-methyl-phenyl-sulfanylidene-λ5-phosphane
CID 12650712
methoxy-(2-methoxyphenyl)-phenyl-sulfanylidene-λ5-phosphane
CID 134996436
bis(dimethylamino)-diphenylphosphinothioyliminophosphanium
CID 23418356
benzyl-methoxy-phenyl-sulfanylidene-lambda5-phosphane
CID 598912
N-ethyl-N-[methoxy(phenyl)phosphinothioyl]ethanamine
CID 12584057
dimethyl-phenyl-sulfanylidene-λ5-phosphane;ethane
CID 91466135
phenoxy-diphenyl-sulfanylidene-lambda5-phosphane
CID 13410918
CID 177475534
CID 177475534
methoxy-phenyl-prop-2-enoxy-sulfanylidene-λ5-phosphane
CID 54357760
(E)-N-diphenylphosphinothioyl-1-(4-fluorophenyl)ethanimine
CID 71528482
methyl-phenyl-sulfanyl-sulfanylidene-lambda5-phosphane
CID 586594
(1R)-1-dimethoxyphosphoryl-N-diphenylphosphinothioyl-1-phenylethanamine
CID 74763188

Frequently Asked Questions

What is the IUPAC name of diphenylphosphinothioylimino-methoxy-diphenyl-λ5-phosphane?
The IUPAC name of diphenylphosphinothioylimino-methoxy-diphenyl-λ5-phosphane (CID 23418380) is diphenylphosphinothioylimino-methoxy-diphenyl-λ5-phosphane.
What is the SMILES notation for diphenylphosphinothioylimino-methoxy-diphenyl-λ5-phosphane?
The canonical SMILES for diphenylphosphinothioylimino-methoxy-diphenyl-λ5-phosphane is COP(=NP(=S)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of diphenylphosphinothioylimino-methoxy-diphenyl-λ5-phosphane?
The InChIKey is ZAUDCNVAAROJLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23NOP2S/c1-27-28(22-14-6-2-7-15-22,23-16-8-3-9-17-23)26-29(30,24-18-10-4-11-19-24)25-20-12-5-13-21-25/h2-21H,1H3.
What are the key properties of diphenylphosphinothioylimino-methoxy-diphenyl-λ5-phosphane?
diphenylphosphinothioylimino-methoxy-diphenyl-λ5-phosphane has a molecular weight of 447.48 g/mol, XLogP of 5.45, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diphenylphosphinothioylimino-methoxy-diphenyl-λ5-phosphane is sourced from PubChem (CID 23418380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).