methyl (2E)-3-[(3,4-difluorophenyl)amino]-2-(2,4-dimethylbenzenesulfonyl)prop-2-enoate

methyl (2E)-3-[(3,4-difluorophenyl)amino]-2-(2,4-dimethylbenzenesulfonyl)prop-2-enoate

Formula: C18H17F2NO4S

SMILES: COC(=O)C(=C/NC1=CC=C(F)C(F)=C1)S(=O)(=O)C1=CC=C(C)C=C1C

IUPAC: methyl (2E)-3-[(3,4-difluorophenyl)amino]-2-(2,4-dimethylbenzenesulfonyl)prop-2-enoate

InChI: InChI=1S/C18H17F2NO4S/c1-11-4-7-16(12(2)8-11)26(23,24)17(18(22)25-3)10-21-13-5-6-14(19)15(20)9-13/h4-10,21H,1-3H3/b17-10+

Composition: C (56.69%), H (4.49%), F (9.96%), N (3.67%), O (16.78%), S (8.41%)

Molar Mass: 381.39

Atom Count: 43

Heavy Atom Count: 26

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	381.084635531
Formal Charge	0
FSP3	0.17
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	PGNVOTWZIIKVSW-LICLKQGHSA-N
Lipinski's Rule of Five	1
Molar Refractivity	96.06
Topological Polar Surface Area	72.47
Polarizability	36.06
Ring Count	2
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H17F2NO4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00