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Megestrol Acetate 500mg

CAT: 0628-A10563-500Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0628-A10563-500Size:500 mg
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CAS Number
595-33-5

Chemical Information

Megestrol Acetate

Megestrol Acetate can cause cancer and developmental toxicity according to state or federal government labeling requirements.

CAS Number595-33-5
PubChem CID11683
IUPAC Name[(8R,9S,10R,13S,14S,17R)-17-acetyl-6,10,13-trimethyl-3-oxo-2,8,9,11,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthren-17-yl] acetate
Molecular FormulaC24H32O4
Molecular Weight384.5
XLogP3.1
Topological Polar Surface Area60.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count28
Formal Charge0
Complexity820
SMILES
CC1=C[C@@H]2[C@H](CC[C@]3([C@H]2CC[C@@]3(C(=O)C)OC(=O)C)C)[C@@]4(C1=CC(=O)CC4)C
InChI
InChI=1S/C24H32O4/c1-14-12-18-19(22(4)9-6-17(27)13-21(14)22)7-10-23(5)20(18)8-11-24(23,15(2)25)28-16(3)26/h12-13,18-20H,6-11H2,1-5H3/t18-,19+,20+,22-,23+,24+/m1/s1
InChIKey
RQZAXGRLVPAYTJ-GQFGMJRRSA-N
Chemical Structure
2D Structure
2D structure of Megestrol Acetate
CAS: 595-33-5
CID: 11683
Formula: C24H32O4
MW: 384.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight384.5
XLogP33.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass384.23005950
Monoisotopic Mass384.23005950
Topological Polar Surface Area60.4 Ų
Heavy Atom Count28
Formal Charge0
Complexity820
Isotope Atom Count0
Defined Atom Stereocenter Count6
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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