3-methyl-2-oxo-N-phenyl-1,4-dihydroquinazoline-6-sulfonamide

C15H15N3O3S — CID 71271969

IUPAC3-methyl-2-oxo-N-phenyl-1,4-dihydroquinazoline-6-sulfonamide
SMILESCN1Cc2cc(S(=O)(=O)Nc3ccccc3)ccc2NC1=O
InChIInChI=1S/C15H15N3O3S/c1-18-10-11-9-13(7-8-14(11)16-15(18)19)22(20,21)17-12-5-3-2-4-6-12/h2-9,17H,10H2,1H3,(H,16,19)
InChIKeyMUQCGKPYCUDNMX-UHFFFAOYSA-N
MW317.37 g/mol
LogP2.46
Rot. Bonds3

About 3-methyl-2-oxo-N-phenyl-1,4-dihydroquinazoline-6-sulfonamide

3-methyl-2-oxo-N-phenyl-1,4-dihydroquinazoline-6-sulfonamide (PubChem CID 71271969) has the molecular formula C15H15N3O3S and a molecular weight of 317.37 g/mol. Its IUPAC name is 3-methyl-2-oxo-N-phenyl-1,4-dihydroquinazoline-6-sulfonamide.

Molecular Properties

Compound Name3-methyl-2-oxo-N-phenyl-1,4-dihydroquinazoline-6-sulfonamide
PubChem CID71271969
Molecular FormulaC15H15N3O3S
Molecular Weight317.37 g/mol
Exact Mass317.08
IUPAC Name3-methyl-2-oxo-N-phenyl-1,4-dihydroquinazoline-6-sulfonamide
SMILESCN1Cc2cc(S(=O)(=O)Nc3ccccc3)ccc2NC1=O
InChIInChI=1S/C15H15N3O3S/c1-18-10-11-9-13(7-8-14(11)16-15(18)19)22(20,21)17-12-5-3-2-4-6-12/h2-9,17H,10H2,1H3,(H,16,19)
InChIKeyMUQCGKPYCUDNMX-UHFFFAOYSA-N
XLogP2.46
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.37
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1,2,3,4-Tetrahydroquinoline-6-sulfonamide
CID 16227153
4-({[2-(1-Methylethyl)phenyl]carbamoyl}amino)benzenesulfonamide
CID 50909908
Benzenesulfonamide, 4-[[[(phenylamino)carbonyl]amino]methyl]-
CID 10614528
4-[(3-Toluidinocarbonyl)amino]benzenesulfonamide
CID 310649
4-(3,4-dihydroquinolin-1(2H)-ylsulfonyl)aniline
CID 221221
N-[4-(3,4-dihydro-1(2H)-quinolinylsulfonyl)phenyl]acetamide
CID 720097
Carbonic anhydrase inhibitor 3
CID 38150302
3-(3-Methyl-3-phenethylureido)benzenesulfonamide
CID 157049317
BRD4 Inhibitor-17
CID 163196475
3-Methyl-6-(Pyrrolidin-1-Ylsulfonyl)-3,4-Dihydroquinazolin-2(1h)-One
CID 66553125
N-octyl-5-(phenylsulfamoyl)-2,3-dihydro-1H-indole-1-carboxamide
CID 44298731
2H-Quinoline-1-carboxylic acid, 6-benzylsulfamoyl-3,4-dihydro-, methyl ester
CID 1511841

Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-oxo-N-phenyl-1,4-dihydroquinazoline-6-sulfonamide?
The IUPAC name of 3-methyl-2-oxo-N-phenyl-1,4-dihydroquinazoline-6-sulfonamide (CID 71271969) is 3-methyl-2-oxo-N-phenyl-1,4-dihydroquinazoline-6-sulfonamide.
What is the SMILES notation for 3-methyl-2-oxo-N-phenyl-1,4-dihydroquinazoline-6-sulfonamide?
The canonical SMILES for 3-methyl-2-oxo-N-phenyl-1,4-dihydroquinazoline-6-sulfonamide is CN1Cc2cc(S(=O)(=O)Nc3ccccc3)ccc2NC1=O.
What is the InChIKey of 3-methyl-2-oxo-N-phenyl-1,4-dihydroquinazoline-6-sulfonamide?
The InChIKey is MUQCGKPYCUDNMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O3S/c1-18-10-11-9-13(7-8-14(11)16-15(18)19)22(20,21)17-12-5-3-2-4-6-12/h2-9,17H,10H2,1H3,(H,16,19).
What are the key properties of 3-methyl-2-oxo-N-phenyl-1,4-dihydroquinazoline-6-sulfonamide?
3-methyl-2-oxo-N-phenyl-1,4-dihydroquinazoline-6-sulfonamide has a molecular weight of 317.37 g/mol, XLogP of 2.46, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-oxo-N-phenyl-1,4-dihydroquinazoline-6-sulfonamide is sourced from PubChem (CID 71271969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).