(2Z)-3-[(4-chlorophenyl)methyl]-2-[(4-fluorophenyl)imino]-4-oxo-1,3-thiazinane-6-carboxylic acid

(2Z)-3-[(4-chlorophenyl)methyl]-2-[(4-fluorophenyl)imino]-4-oxo-1,3-thiazinane-6-carboxylic acid

Formula: C18H14ClFN2O3S

SMILES: OC(=O)C1CC(=O)N(CC2=CC=C(Cl)C=C2)C(S1)=NC1=CC=C(F)C=C1

IUPAC: (2Z)-3-[(4-chlorophenyl)methyl]-2-[(4-fluorophenyl)imino]-4-oxo-1,3-thiazinane-6-carboxylic acid

InChI: InChI=1/C18H14ClFN2O3S/c19-12-3-1-11(2-4-12)10-22-16(23)9-15(17(24)25)26-18(22)21-14-7-5-13(20)6-8-14/h1-8,15H,9-10H2,(H,24,25)/b21-18-

Composition: C (55.04%), H (3.59%), Cl (9.02%), F (4.84%), N (7.13%), O (12.22%), S (8.16%)

Molar Mass: 392.83

Atom Count: 40

Heavy Atom Count: 26

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	392.0397694
Formal Charge	0
FSP3	0.17
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	ILMPJKSFCKNTQC-UZYVYHOENA-N
Lipinski's Rule of Five	1
Molar Refractivity	99.34
Topological Polar Surface Area	69.97
Polarizability	37.39
Ring Count	3
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H14ClFN2O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00