Antineoplastic-273414 structure

Antineoplastic-273414

17-[bis(aziridin-1-yl)phosphoryloxy]-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one

Also Known As: ANTINEOPLASTIC-273414|3-Oxoandrost-4-en-17-yl bis(aziridin-1-yl)phosphinate|3-Oxoandrost-4-en-17-yl bis[(aziridin-1-yl)]phosphinate|17-[bis(aziridin-1-yl)phosphoryloxy]-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one

CAS: 7065-66-9
Molecular Formula C23H35N2O3P
Molecular Weight 418.23853 g/mol
LogP 3.2
Topological Polar Surface Area 49.4 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 5
Rotatable Bonds 4
Exact Mass 418.23853
Monoisotopic Mass 418.23853
Heavy Atoms 29
Complexity 803.0

Chemical Identifiers

CAS Number 7065-66-9
SMILES CC12CCC3C(C1CCC2OP(=O)(N4CC4)N5CC5)CCC6=CC(=O)CCC36C
InChIKey QCLKOEHQDXOBGN-UHFFFAOYSA-N

Product Overview

Antineoplastic-273414 (CAS 7065-66-9), with molecular formula C23H35N2O3P and molecular weight 418.23853 g/mol. IUPAC: 17-[bis(aziridin-1-yl)phosphoryloxy]-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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