AR-1C1132

(17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl) 2-[[2-chloroethyl(nitroso)carbamoyl]amino]propanoate

Also Known As: N-(2-Chloroethyl)-N-nitrosocarbamoyl-L-alanine-estradiol-3-ester|17-hydroxyestra-1,3,5(10)-trien-3-yl n-[(2-chloroethyl)(nitroso)carbamoyl]alaninate|(17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl) 2-[[2-chloroethyl(nitroso)carbamoyl]amino]propanoate|L-Alanine, N-(((2-chloroethyl)nitrosoamino)carbonyl)-, (17-beta)-17-hydroxyestra-1,3,5(10)-trien-3-yl ester|N-(2-Chloroethyl)-N'-(1-{[17-hydroxyestra-1(10),2,4-trien-3-yl]oxy}-1-oxopropan-2-yl)-N-nitrosocarbamimidic acid

Molecular Formula	C24H32ClN3O5
Molecular Weight	477.20306 g/mol
LogP	4.13
Topological Polar Surface Area	108.3 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	6
Exact Mass	477.20306
Heavy Atoms	33
Complexity	927.4

Chemical Identifiers

CAS Number	89083-85-2
SMILES	CC(C(=O)OC1=CC2=C(C=C1)C3CCC4(C(C3CC2)CCC4O)C)NC(=O)N(CCCl)N=O