2-(2-phenylquinazolin-4-yl)sulfanyl-N-(1,3-thiazol-2-yl)acetamide

C19H14N4OS2 — CID 1072346

IUPAC2-(2-phenylquinazolin-4-yl)sulfanyl-N-(1,3-thiazol-2-yl)acetamide
SMILESO=C(CSc1nc(-c2ccccc2)nc2ccccc12)Nc1nccs1
InChIInChI=1S/C19H14N4OS2/c24-16(22-19-20-10-11-25-19)12-26-18-14-8-4-5-9-15(14)21-17(23-18)13-6-2-1-3-7-13/h1-11H,12H2,(H,20,22,24)
InChIKeyZJQDZYGXORTRFV-UHFFFAOYSA-N
MW378.48 g/mol
LogP4.48
Rot. Bonds5

About 2-(2-phenylquinazolin-4-yl)sulfanyl-N-(1,3-thiazol-2-yl)acetamide

2-(2-phenylquinazolin-4-yl)sulfanyl-N-(1,3-thiazol-2-yl)acetamide (PubChem CID 1072346) has the molecular formula C19H14N4OS2 and a molecular weight of 378.48 g/mol. Its IUPAC name is 2-(2-phenylquinazolin-4-yl)sulfanyl-N-(1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(2-phenylquinazolin-4-yl)sulfanyl-N-(1,3-thiazol-2-yl)acetamide
PubChem CID1072346
Molecular FormulaC19H14N4OS2
Molecular Weight378.48 g/mol
Exact Mass378.06
IUPAC Name2-(2-phenylquinazolin-4-yl)sulfanyl-N-(1,3-thiazol-2-yl)acetamide
SMILESO=C(CSc1nc(-c2ccccc2)nc2ccccc12)Nc1nccs1
InChIInChI=1S/C19H14N4OS2/c24-16(22-19-20-10-11-25-19)12-26-18-14-8-4-5-9-15(14)21-17(23-18)13-6-2-1-3-7-13/h1-11H,12H2,(H,20,22,24)
InChIKeyZJQDZYGXORTRFV-UHFFFAOYSA-N
XLogP4.48
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.48
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-(2-phenylquinazolin-4-yl)sulfanyl-N-(1,3-thiazol-2-yl)acetamide 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 2-(2-phenylquinazolin-4-yl)sulfanyl-N-(1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-(2-phenylquinazolin-4-yl)sulfanyl-N-(1,3-thiazol-2-yl)acetamide (CID 1072346) is 2-(2-phenylquinazolin-4-yl)sulfanyl-N-(1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-(2-phenylquinazolin-4-yl)sulfanyl-N-(1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-(2-phenylquinazolin-4-yl)sulfanyl-N-(1,3-thiazol-2-yl)acetamide is O=C(CSc1nc(-c2ccccc2)nc2ccccc12)Nc1nccs1.
What is the InChIKey of 2-(2-phenylquinazolin-4-yl)sulfanyl-N-(1,3-thiazol-2-yl)acetamide?
The InChIKey is ZJQDZYGXORTRFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N4OS2/c24-16(22-19-20-10-11-25-19)12-26-18-14-8-4-5-9-15(14)21-17(23-18)13-6-2-1-3-7-13/h1-11H,12H2,(H,20,22,24).
What are the key properties of 2-(2-phenylquinazolin-4-yl)sulfanyl-N-(1,3-thiazol-2-yl)acetamide?
2-(2-phenylquinazolin-4-yl)sulfanyl-N-(1,3-thiazol-2-yl)acetamide has a molecular weight of 378.48 g/mol, XLogP of 4.48, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenylquinazolin-4-yl)sulfanyl-N-(1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 1072346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).