N-{2-[(2-methoxyethyl)carbamoyl]phenyl}-4-methyl-3-(pyrrolidine-1-sulfonyl)benzamide

N-{2-[(2-methoxyethyl)carbamoyl]phenyl}-4-methyl-3-(pyrrolidine-1-sulfonyl)benzamide

Formula: C22H27N3O5S

SMILES: COCCNC(=O)C1=CC=CC=C1NC(=O)C1=CC=C(C)C(=C1)S(=O)(=O)N1CCCC1

IUPAC: N-{2-[(2-methoxyethyl)carbamoyl]phenyl}-4-methyl-3-(pyrrolidine-1-sulfonyl)benzamide

InChI: InChI=1S/C22H27N3O5S/c1-16-9-10-17(15-20(16)31(28,29)25-12-5-6-13-25)21(26)24-19-8-4-3-7-18(19)22(27)23-11-14-30-2/h3-4,7-10,15H,5-6,11-14H2,1-2H3,(H,23,27)(H,24,26)

Composition: C (59.31%), H (6.11%), N (9.43%), O (17.95%), S (7.20%)

Molar Mass: 445.53

Atom Count: 58

Heavy Atom Count: 31

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	445.167142155
Formal Charge	0
FSP3	0.36
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	GJEAYWHLQSTGHV-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	121.14
Topological Polar Surface Area	104.81
Polarizability	45.71
Ring Count	3
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C22H27N3O5S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00