AC1MIO1L

methyl (4S,5R,6S)-6-hydroxy-6-methyl-3-oxo-4-phenyl-2,4,5,7-tetrahydro-1H-indazole-5-carboxylate

Also Known As: BAS 11409592|2H-Indazole-5-carboxylic acid, 4,5,6,7-tetrahydro-, 3,6-dihydroxy-6-methyl-4-phenyl-, methyl ester, (4-alpha,5-beta,6-alpha)-|Methyl (4S,5R,6S)-6-hydroxy-6-methyl-3-oxo-4-phenyl-2,3,4,5,6,7-hexahydro-1H-indazole-5-carboxylate|methyl (4S,5R,6S)-6-hydroxy-6-methyl-3-oxo-4-phenyl-2,4,5,7-tetrahydro-1H-indazole-5-carboxylate

Molecular Formula	C16H18N2O4
Molecular Weight	302.12665 g/mol
LogP	0.9312
Topological Polar Surface Area	95.18 Ų
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	4
Rotatable Bonds	2
Exact Mass	302.12665
Monoisotopic Mass	302.12665
Heavy Atoms	22
Complexity	745.00635

Chemical Identifiers

CAS Number	64670-47-9
SMILES	C[C@@]1(CC2=C([C@@H]([C@H]1C(=O)OC)C3=CC=CC=C3)C(=O)NN2)O