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DMAA

CAT: 0013-GTR19235480-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19235480-01Size:50 mg
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Description
DMAA (1,3-dimethylamylamine) is an indirect sympathomimetic amine that induces vasoconstriction and elevates blood pressure. This pharmacological profile makes it a relevant compound for in vitro and in vivo research in cardiovascular and neurological studies.
CAS Number
73671-86-0
Smiles
C[C@@]12[C@@]3 ([C@] ([C@]4 ([C@] (C) (CC3) [C@@H] (C (N (CC) CC) =O) CC4) [H]) (CC[C@]1 (N (C) C (=O) CC2) [H]) [H]) [H]
Molecular Formula
C24H40N2O2
Molecular Weight
388.59
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

17beta-N,N-Diethylcarbamoyl-4-methyl-4-aza-5alpha-androstan-3-one

inhibitor of testosterone 5-alpha reductase, receptor binding & nuclear uptake of androgens in the prostate

CAS Number73671-86-0
PubChem CID6917653
IUPAC Name(1S,3aS,3bS,5aR,9aR,9bS,11aS)-N,N-diethyl-6,9a,11a-trimethyl-7-oxo-2,3,3a,3b,4,5,5a,8,9,9b,10,11-dodecahydro-1H-indeno[5,4-f]quinoline-1-carboxamide
Molecular FormulaC24H40N2O2
Molecular Weight388.6
XLogP4.1
Topological Polar Surface Area40.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count28
Formal Charge0
Complexity645
SMILES
CCN(CC)C(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CCC(=O)N4C)C)C
InChI
InChI=1S/C24H40N2O2/c1-6-26(7-2)22(28)19-10-9-17-16-8-11-20-24(4,15-13-21(27)25(20)5)18(16)12-14-23(17,19)3/h16-20H,6-15H2,1-5H3/t16-,17-,18-,19+,20+,23-,24+/m0/s1
InChIKey
GNWBLLYJQXKPIP-ZOGIJGBBSA-N
Chemical Structure
2D Structure
2D structure of 17beta-N,N-Diethylcarbamoyl-4-methyl-4-aza-5alpha-androstan-3-one
CAS: 73671-86-0
CID: 6917653
Formula: C24H40N2O2
MW: 388.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight388.6
XLogP34.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass388.308978523
Monoisotopic Mass388.308978523
Topological Polar Surface Area40.6 Ų
Heavy Atom Count28
Formal Charge0
Complexity645
Isotope Atom Count0
Defined Atom Stereocenter Count7
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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