2-[3-(azepane-1-carbonyl)-4-methoxybenzenesulfonamido]-N-(2-methoxyethyl)benzamide

2-[3-(azepane-1-carbonyl)-4-methoxybenzenesulfonamido]-N-(2-methoxyethyl)benzamide

Formula: C24H31N3O6S

SMILES: COCCNC(=O)C1=CC=CC=C1NS(=O)(=O)C1=CC=C(OC)C(=C1)C(=O)N1CCCCCC1

IUPAC: 2-[3-(azepane-1-carbonyl)-4-methoxybenzenesulfonamido]-N-(2-methoxyethyl)benzamide

InChI: InChI=1S/C24H31N3O6S/c1-32-16-13-25-23(28)19-9-5-6-10-21(19)26-34(30,31)18-11-12-22(33-2)20(17-18)24(29)27-14-7-3-4-8-15-27/h5-6,9-12,17,26H,3-4,7-8,13-16H2,1-2H3,(H,25,28)

Composition: C (58.88%), H (6.38%), N (8.58%), O (19.61%), S (6.55%)

Molar Mass: 489.59

Atom Count: 65

Heavy Atom Count: 34

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	489.193356904
Formal Charge	0
FSP3	0.42
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	2
InChIKey	GZJYRQUWKGDNJR-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	129.99
Topological Polar Surface Area	114.04
Polarizability	49.97
Ring Count	3
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C24H31N3O6S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00