methyl (2E)-2-(4-ethylbenzenesulfonyl)-3-[(4-fluorophenyl)amino]prop-2-enoate

methyl (2E)-2-(4-ethylbenzenesulfonyl)-3-[(4-fluorophenyl)amino]prop-2-enoate

Formula: C18H18FNO4S

SMILES: CCC1=CC=C(C=C1)S(=O)(=O)C(=CNC1=CC=C(F)C=C1)C(=O)OC

IUPAC: methyl (2E)-2-(4-ethylbenzenesulfonyl)-3-[(4-fluorophenyl)amino]prop-2-enoate

InChI: InChI=1S/C18H18FNO4S/c1-3-13-4-10-16(11-5-13)25(22,23)17(18(21)24-2)12-20-15-8-6-14(19)7-9-15/h4-12,20H,3H2,1-2H3/b17-12+

Composition: C (59.49%), H (4.99%), F (5.23%), N (3.85%), O (17.61%), S (8.82%)

Molar Mass: 363.4

Atom Count: 43

Heavy Atom Count: 25

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	363.094057401
Formal Charge	0
FSP3	0.17
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	LZJVKSIQDBJDLP-SFQUDFHCSA-N
Lipinski's Rule of Five	1
Molar Refractivity	95.41
Topological Polar Surface Area	72.47
Polarizability	36.39
Ring Count	2
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H18FNO4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00