Name: Name:3-(2,5-dimethylphenyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one
Brand: Angene
SKU: AG019J6Y
Rating: 90 (10 reviews)

3-(2,5-dimethylphenyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one

CAS No.:

105363-09-5

Catalog Number:

AG019J6Y

Molecular Formula:

C16H14N2OS

Molecular Weight:

282.3602

Catalog Number:

AG019J6Y

Chemical Name:

3-(2,5-dimethylphenyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one

CAS Number:

105363-09-5

Molecular Formula:

C16H14N2OS

Molecular Weight:

282.3602

MDL Number:

MFCD03194615

IUPAC Name:

3-(2,5-dimethylphenyl)-2-sulfanylidene-1H-quinazolin-4-one

InChI:

InChI=1S/C16H14N2OS/c1-10-7-8-11(2)14(9-10)18-15(19)12-5-3-4-6-13(12)17-16(18)20/h3-9H,1-2H3,(H,17,20)

InChI Key:

PHLDWLVMKYXXNE-UHFFFAOYSA-N

SMILES:

Cc1ccc(c(c1)n1c(S)nc2c(c1=O)cccc2)C

Complexity:

411

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

282.083g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

282.361g/mol

Monoisotopic Mass:

282.083g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

64.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.5