(2Z)-3-benzyl-N-ethyl-2-[(4-methoxyphenyl)imino]-4-oxo-1,3-thiazinane-6-carboxamide

(2Z)-3-benzyl-N-ethyl-2-[(4-methoxyphenyl)imino]-4-oxo-1,3-thiazinane-6-carboxamide

Formula: C21H23N3O3S

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

IUPAC: (2Z)-3-benzyl-N-ethyl-2-[(4-methoxyphenyl)imino]-4-oxo-1,3-thiazinane-6-carboxamide

InChI: InChI=1/C21H23N3O3S/c1-3-22-20(26)18-13-19(25)24(14-15-7-5-4-6-8-15)21(28-18)23-16-9-11-17(27-2)12-10-16/h4-12,18H,3,13-14H2,1-2H3,(H,22,26)/b23-21-

Composition: C (63.46%), H (5.83%), N (10.57%), O (12.07%), S (8.07%)

Molar Mass: 397.49

Atom Count: 51

Heavy Atom Count: 28

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	397.146012787
Formal Charge	0
FSP3	0.29
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	YZGKPAHIMSMZGZ-LNVKXUELNA-N
Lipinski's Rule of Five	1
Molar Refractivity	112.25
Topological Polar Surface Area	71
Polarizability	42.66
Ring Count	3
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C21H23N3O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00