(2E)-2-cyano-N-{4-[(2,6-dimethylphenyl)sulfamoyl]phenyl}-3-(2,4,5-trimethoxyphenyl)prop-2-enamide

(2E)-2-cyano-N-{4-[(2,6-dimethylphenyl)sulfamoyl]phenyl}-3-(2,4,5-trimethoxyphenyl)prop-2-enamide

Formula: C27H27N3O6S

SMILES: COC1=CC(OC)=C(OC)C=C1C=C(/C#N)C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC1=C(C)C=CC=C1C

IUPAC: (2E)-2-cyano-N-{4-[(2,6-dimethylphenyl)sulfamoyl]phenyl}-3-(2,4,5-trimethoxyphenyl)prop-2-enamide

InChI: InChI=1S/C27H27N3O6S/c1-17-7-6-8-18(2)26(17)30-37(32,33)22-11-9-21(10-12-22)29-27(31)20(16-28)13-19-14-24(35-4)25(36-5)15-23(19)34-3/h6-15,30H,1-5H3,(H,29,31)/b20-13+

Composition: C (62.17%), H (5.22%), N (8.06%), O (18.40%), S (6.15%)

Molar Mass: 521.59

Atom Count: 64

Heavy Atom Count: 37

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	521.162056775
Formal Charge	0
FSP3	0.19
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	2
InChIKey	GZTSUFABIPHNFO-DEDYPNTBSA-N
Lipinski's Rule of Five
Molar Refractivity	142.69
Topological Polar Surface Area	126.75
Polarizability	54.05
Ring Count	3
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C27H27N3O6S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00