AC1MVRDG

3-[[4-methyl-5-[2-[3-methyl-5-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]-1,2,4-triazol-3-yl]sulfanyl]-4-oxo-4-phenylbutanoic acid

Also Known As: KS-00003FAU|3-[(4-methyl-5-{2-[3-methyl-5-(trifluoromethyl)-1H-pyrazol-1-yl]-1,3-thiazol-4-yl}-4H-1,2,4-triazol-3-yl)sulfanyl]-4-oxo-4-phenylbutanoic acid|8X-0863|3-[[4-methyl-5-[2-[3-methyl-5-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]-1,2,4-triazol-3-yl]sulfanyl]-4-oxo-4-phenylbutanoic acid|3-[(4-methyl-5-{2-[3-methyl-5-(trifluoromethyl)-1H-pyrazol-1-yl]-1,3-thiazol-4-yl}-4H-1,2,4-triazol-3-yl)sulfanyl]-4-oxo-4-phenylbutanoicacid|3-[(4-methyl-5-{2-[3-methyl-5-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl}-1,2,4-triazol-3-yl)sulfanyl]-4-oxo-4-phenylbutanoic acid

Molecular Formula	C21H17F3N6O3S2
Molecular Weight	522.07556 g/mol
LogP	4.26982
Topological Polar Surface Area	115.79 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	8
Rotatable Bonds	8
Exact Mass	522.07556
Monoisotopic Mass	522.07556
Heavy Atoms	35
Complexity	1380.6084

Chemical Identifiers

CAS Number	956357-63-4
SMILES	CC1=NN(C(=C1)C(F)(F)F)C2=NC(=CS2)C3=NN=C(N3C)SC(CC(=O)O)C(=O)C4=CC=CC=C4