NEINH

N-[[(8R,9S,10R,13S,14S,17R)-17-ethynyl-17-hydroxy-13-methyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-ylidene]amino]pyridine-4-carboxamide

Also Known As: NEINH|Norethindrone isonicotinyl hydrazone|4-Pyridinecarboxylic acid, ((17alpha)-17-hydroxy-19-norpregn-4-en-20-yn-3-ylidene)hydrazide

Molecular Formula	C26H31N3O2
Molecular Weight	417.24164 g/mol
LogP	4.1
Topological Polar Surface Area	74.58 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	2
Exact Mass	417.24164
Heavy Atoms	31
Complexity	978.1

Chemical Identifiers

CAS Number	86762-75-6
SMILES	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=CC(=NNC(=O)C5=CC=NC=C5)CC[C@H]34