3,5-diphenyl-1,2,4-thiazaphosphole

C14H10NPS — CID 14148104

IUPAC3,5-diphenyl-1,2,4-thiazaphosphole
SMILESc1ccc(-c2nsc(-c3ccccc3)p2)cc1
InChIInChI=1S/C14H10NPS/c1-3-7-11(8-4-1)13-15-17-14(16-13)12-9-5-2-6-10-12/h1-10H
InChIKeyLKGBIUVQUSUJBT-UHFFFAOYSA-N
MW255.28 g/mol
LogP5.06
Rot. Bonds2

About 3,5-diphenyl-1,2,4-thiazaphosphole

3,5-diphenyl-1,2,4-thiazaphosphole (PubChem CID 14148104) has the molecular formula C14H10NPS and a molecular weight of 255.28 g/mol. Its IUPAC name is 3,5-diphenyl-1,2,4-thiazaphosphole.

Molecular Properties

Compound Name3,5-diphenyl-1,2,4-thiazaphosphole
PubChem CID14148104
Molecular FormulaC14H10NPS
Molecular Weight255.28 g/mol
Exact Mass255.03
IUPAC Name3,5-diphenyl-1,2,4-thiazaphosphole
SMILESc1ccc(-c2nsc(-c3ccccc3)p2)cc1
InChIInChI=1S/C14H10NPS/c1-3-7-11(8-4-1)13-15-17-14(16-13)12-9-5-2-6-10-12/h1-10H
InChIKeyLKGBIUVQUSUJBT-UHFFFAOYSA-N
XLogP5.06
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500255.28
LogP ≤ 55.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3,5-diphenyl-1,2,4-thiazaphosphole with MolForge

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

Launch Full Analysis

Related Compounds

5-Phenyl-1,2,3,4-thiatriazole
CID 141919
3,5-Diphenyl-4H-1,2,4-diazaphosphole
CID 14000518
3,5-Diphenyl-1,2-diaza-4-phosphanidacyclopenta-2,5-diene
CID 101861870
3-Phenyl-5-trimethylsilanyl-[1,2,4]thiazaphosphole
CID 14148101
5-Tert-butyl-3-phenyl-1,2,4-thiazaphosphole
CID 5325068
3-Benzyl-5-phenyldithiadiazole 2-oxide
CID 142771215
2,5-Diphenyl-1,3,4-thiazaphosphole
CID 13383241
Trimethyl-[3-(2-methylphenyl)-1,2,4-thiazaphosphol-5-yl]silane
CID 14148102
Trimethyl-[3-(4-methylphenyl)-1,2,4-thiazaphosphol-5-yl]silane
CID 14148103
3-(4-Methylphenyl)-5-phenyl-1,2,4-thiazaphosphole
CID 14148105
3,5-Diphenyl-1,4,2-dithiazol-4-ium
CID 85595615

Frequently Asked Questions

What is the IUPAC name of 3,5-diphenyl-1,2,4-thiazaphosphole?
The IUPAC name of 3,5-diphenyl-1,2,4-thiazaphosphole (CID 14148104) is 3,5-diphenyl-1,2,4-thiazaphosphole.
What is the SMILES notation for 3,5-diphenyl-1,2,4-thiazaphosphole?
The canonical SMILES for 3,5-diphenyl-1,2,4-thiazaphosphole is c1ccc(-c2nsc(-c3ccccc3)p2)cc1.
What is the InChIKey of 3,5-diphenyl-1,2,4-thiazaphosphole?
The InChIKey is LKGBIUVQUSUJBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10NPS/c1-3-7-11(8-4-1)13-15-17-14(16-13)12-9-5-2-6-10-12/h1-10H.
What are the key properties of 3,5-diphenyl-1,2,4-thiazaphosphole?
3,5-diphenyl-1,2,4-thiazaphosphole has a molecular weight of 255.28 g/mol, XLogP of 5.06, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-diphenyl-1,2,4-thiazaphosphole is sourced from PubChem (CID 14148104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).