AC1LJ4W7

methyl (2Z)-2-[6-oxo-3-(2-phenylethyl)-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-7-ylidene]acetate

Also Known As: methyl (2Z)-[6-oxo-3-(2-phenylethyl)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-7(6H)-ylidene]ethanoate|(Z)-methyl 2-(6-oxo-3-phenethyl-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-7(6H)-ylidene)acetate|Methyl 2-(9-oxo-3-phenethyl-7-thia-1,3,5-triazabicyclo[4.3.0]non-5-en-8-ylidene)acetate|methyl (2Z)-2-(6-oxo-3-phenethyl-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-7-ylidene)acetate|methyl 2-[6-oxo-3-(2-phenylethyl)-2H,4H-1,3-thiazolidino[3,2-e]1,3,5-triazin-7 -ylidene]acetate

Molecular Formula	C16H17N3O3S
Molecular Weight	331.09906 g/mol
LogP	-0.0438
Topological Polar Surface Area	63.9 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	6
Rotatable Bonds	4
Exact Mass	331.09906
Monoisotopic Mass	331.09906
Heavy Atoms	23
Complexity	870.2108

Chemical Identifiers

CAS Number	669752-50-5
SMILES	COC(=O)/C=C\1/C(=O)N2CN(CN=C2S1)CCC3=CC=CC=C3