2-{2-[N-(3-chlorophenyl)benzenesulfonamido]acetamido}benzoic acid

2-{2-[N-(3-chlorophenyl)benzenesulfonamido]acetamido}benzoic acid

Formula: C21H17ClN2O5S

SMILES: OC(=O)C1=CC=CC=C1NC(=O)CN(C1=CC(Cl)=CC=C1)S(=O)(=O)C1=CC=CC=C1

IUPAC: 2-{2-[N-(3-chlorophenyl)benzenesulfonamido]acetamido}benzoic acid

InChI: InChI=1S/C21H17ClN2O5S/c22-15-7-6-8-16(13-15)24(30(28,29)17-9-2-1-3-10-17)14-20(25)23-19-12-5-4-11-18(19)21(26)27/h1-13H,14H2,(H,23,25)(H,26,27)

Composition: C (56.70%), H (3.85%), Cl (7.97%), N (6.30%), O (17.98%), S (7.21%)

Molar Mass: 444.89

Atom Count: 47

Heavy Atom Count: 30

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	444.0546705
Formal Charge	0
FSP3	0.05
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	ANLVKOOIBWTTBA-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	114.21
Topological Polar Surface Area	103.78
Polarizability	43.92
Ring Count	3
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C21H17ClN2O5S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00