4-methyl-N-(3-methyl-4-oxoquinazolin-6-yl)benzenesulfonamide

C16H15N3O3S — CID 169372734

IUPAC4-methyl-N-(3-methyl-4-oxoquinazolin-6-yl)benzenesulfonamide
SMILESCc1ccc(S(=O)(=O)Nc2ccc3ncn(C)c(=O)c3c2)cc1
InChIInChI=1S/C16H15N3O3S/c1-11-3-6-13(7-4-11)23(21,22)18-12-5-8-15-14(9-12)16(20)19(2)10-17-15/h3-10,18H,1-2H3
InChIKeyPVHNMTSONAROGO-UHFFFAOYSA-N
MW329.38 g/mol
LogP2.04
Rot. Bonds3

About 4-methyl-N-(3-methyl-4-oxoquinazolin-6-yl)benzenesulfonamide

4-methyl-N-(3-methyl-4-oxoquinazolin-6-yl)benzenesulfonamide (PubChem CID 169372734) has the molecular formula C16H15N3O3S and a molecular weight of 329.38 g/mol. Its IUPAC name is 4-methyl-N-(3-methyl-4-oxoquinazolin-6-yl)benzenesulfonamide.

Molecular Properties

Compound Name4-methyl-N-(3-methyl-4-oxoquinazolin-6-yl)benzenesulfonamide
PubChem CID169372734
Molecular FormulaC16H15N3O3S
Molecular Weight329.38 g/mol
Exact Mass329.08
IUPAC Name4-methyl-N-(3-methyl-4-oxoquinazolin-6-yl)benzenesulfonamide
SMILESCc1ccc(S(=O)(=O)Nc2ccc3ncn(C)c(=O)c3c2)cc1
InChIInChI=1S/C16H15N3O3S/c1-11-3-6-13(7-4-11)23(21,22)18-12-5-8-15-14(9-12)16(20)19(2)10-17-15/h3-10,18H,1-2H3
InChIKeyPVHNMTSONAROGO-UHFFFAOYSA-N
XLogP2.04
TPSA81.06 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.38
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-methyl-N-(3-methyl-4-oxoquinazolin-6-yl)benzenesulfonamide 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

N-[3-(4-cyanobenzoyl)-4-oxoquinazolin-6-yl]-4-methylbenzenesulfonamide
CID 175232044
N-(1,3-dimethylindol-6-yl)-4-methylbenzenesulfonamide
CID 169371827
N-[4-[(4-methylphenyl)sulfonylamino]phenyl]-3-(4-oxoquinazolin-3-yl)propanamide
CID 55471858
4-methyl-N-(1-methylbenzotriazol-5-yl)benzenesulfonamide
CID 169370714
4-methyl-N-(3-oxo-1,2-dihydroindazol-5-yl)benzenesulfonamide
CID 169370724
N-[2-(4-chlorophenyl)benzotriazol-5-yl]-4-methylbenzenesulfonamide
CID 169371169
N-(4-methylphenyl)-4-[4-[(4-methylphenyl)sulfamoyl]phenyl]benzenesulfonamide
CID 4994558
N-benzo[b][1,7]phenanthrolin-10-yl-4-methylbenzenesulfonamide
CID 11133109
N-(1-benzylbenzimidazol-5-yl)-4-methylbenzenesulfonamide
CID 1373136
N-[1-(4-methoxyphenyl)benzimidazol-5-yl]-4-methylbenzenesulfonamide
CID 1097865
4-methyl-N-(6-methyl-3-pyridinyl)benzenesulfonamide
CID 84581619
N-[4-(3,5-dimethylpyrazol-1-yl)phenyl]-4-methylbenzenesulfonamide
CID 36591359

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(3-methyl-4-oxoquinazolin-6-yl)benzenesulfonamide?
The IUPAC name of 4-methyl-N-(3-methyl-4-oxoquinazolin-6-yl)benzenesulfonamide (CID 169372734) is 4-methyl-N-(3-methyl-4-oxoquinazolin-6-yl)benzenesulfonamide.
What is the SMILES notation for 4-methyl-N-(3-methyl-4-oxoquinazolin-6-yl)benzenesulfonamide?
The canonical SMILES for 4-methyl-N-(3-methyl-4-oxoquinazolin-6-yl)benzenesulfonamide is Cc1ccc(S(=O)(=O)Nc2ccc3ncn(C)c(=O)c3c2)cc1.
What is the InChIKey of 4-methyl-N-(3-methyl-4-oxoquinazolin-6-yl)benzenesulfonamide?
The InChIKey is PVHNMTSONAROGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O3S/c1-11-3-6-13(7-4-11)23(21,22)18-12-5-8-15-14(9-12)16(20)19(2)10-17-15/h3-10,18H,1-2H3.
What are the key properties of 4-methyl-N-(3-methyl-4-oxoquinazolin-6-yl)benzenesulfonamide?
4-methyl-N-(3-methyl-4-oxoquinazolin-6-yl)benzenesulfonamide has a molecular weight of 329.38 g/mol, XLogP of 2.04, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(3-methyl-4-oxoquinazolin-6-yl)benzenesulfonamide is sourced from PubChem (CID 169372734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).