AC1LDGZK

3-(1,3-benzodioxol-5-ylmethyl)-N-ethyl-2-(4-fluorophenyl)imino-4-oxo-1,3-thiazinane-6-carboxamide

Also Known As: NCGC00035948-02|BAS 02867109|A3250/0138073|(2Z)-3-(1,3-benzodioxol-5-ylmethyl)-N-ethyl-2-[(4-fluorophenyl)imino]-4-oxo-1,3-thiazinane-6-carboxamide|(Z)-3-(benzo[d][1,3]dioxol-5-ylmethyl)-N-ethyl-2-((4-fluorophenyl)imino)-4-oxo-1,3-thiazinane-6-carboxamide|(2Z)-3-[(2H-13-BENZODIOXOL-5-YL)METHYL]-N-ETHYL-2-[(4-FLUOROPHENYL)IMINO]-4-OXO-13-THIAZINANE-6-CARBOXAMIDE|{3-(2H-benzo[3,4-d]1,3-dioxolan-5-ylmethyl)-2-[(4-fluorophenyl)azamethylene]-4 -oxo(1,3-thiazaperhydroin-6-yl)}-N-ethylcarboxamide|3-(1,3-benzodioxol-5-ylmethyl)-N-ethyl-2-(4-fluorophenyl)imino-4-oxo-1,3-thiazinane-6-carboxamide|3-Benzo[1,3]dioxol-5-ylmethyl-2-[(Z)-4-fluoro-phenylimino]-4-oxo-[1,3]thiazinane-6-carboxylic acid ethylamide

Molecular Formula	C21H20FN3O4S
Molecular Weight	429.11584 g/mol
LogP	3.1
Topological Polar Surface Area	106.0 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	7
Rotatable Bonds	5
Exact Mass	429.11584
Monoisotopic Mass	429.11584
Heavy Atoms	30
Complexity	671.0

Chemical Identifiers

CAS Number	1164523-59-4
SMILES	CCNC(=O)C1CC(=O)N(C(=NC2=CC=C(C=C2)F)S1)CC3=CC4=C(C=C3)OCO4
InChIKey	UPCCYAMXKFGBAO-UHFFFAOYSA-N