Name: Name:2-({[(4-fluorophenyl)carbamoyl]methyl}sulfanyl)benzoic acid
Brand: Angene
SKU: AG019OZL
Rating: 90 (10 reviews)

2-({[(4-fluorophenyl)carbamoyl]methyl}sulfanyl)benzoic acid

CAS No.:

851288-58-9

Catalog Number:

AG019OZL

Molecular Formula:

C15H12FNO3S

Molecular Weight:

305.3241

Catalog Number:

AG019OZL

Chemical Name:

2-({[(4-fluorophenyl)carbamoyl]methyl}sulfanyl)benzoic acid

CAS Number:

851288-58-9

Molecular Formula:

C15H12FNO3S

Molecular Weight:

305.3241

MDL Number:

MFCD06378236

IUPAC Name:

2-[2-(4-fluoroanilino)-2-oxoethyl]sulfanylbenzoic acid

InChI:

InChI=1S/C15H12FNO3S/c16-10-5-7-11(8-6-10)17-14(18)9-21-13-4-2-1-3-12(13)15(19)20/h1-8H,9H2,(H,17,18)(H,19,20)

InChI Key:

SPNDUUNNSMVJOM-UHFFFAOYSA-N

SMILES:

O=C(Nc1ccc(cc1)F)CSc1ccccc1C(=O)O

Complexity:

372

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

305.052g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

305.323g/mol

Monoisotopic Mass:

305.052g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

91.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3: