4-chloro-N-(3-nitrophenyl)-3-(pyrrolidine-1-sulfonyl)benzamide

4-chloro-N-(3-nitrophenyl)-3-(pyrrolidine-1-sulfonyl)benzamide

Formula: C17H16ClN3O5S

SMILES: [O-][N+](=O)C1=CC(NC(=O)C2=CC=C(Cl)C(=C2)S(=O)(=O)N2CCCC2)=CC=C1

IUPAC: 4-chloro-N-(3-nitrophenyl)-3-(pyrrolidine-1-sulfonyl)benzamide

InChI: InChI=1S/C17H16ClN3O5S/c18-15-7-6-12(10-16(15)27(25,26)20-8-1-2-9-20)17(22)19-13-4-3-5-14(11-13)21(23)24/h3-7,10-11H,1-2,8-9H2,(H,19,22)

Composition: C (49.82%), H (3.94%), Cl (8.65%), N (10.25%), O (19.52%), S (7.82%)

Molar Mass: 409.84

Atom Count: 43

Heavy Atom Count: 27

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	409.0499195
Formal Charge	0
FSP3	0.24
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	XURNCPDUSZQGGH-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	102.21
Topological Polar Surface Area	109.62
Polarizability	38.75
Ring Count	3
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C17H16ClN3O5S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00