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Capromorelin Tartrate 100mg

CAT: 0628-A21238-100Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0628-A21238-100Size:100 mg
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CAS Number
193273-69-7

Chemical Information

Capromorelin Tartrate

See also: Capromorelin (has active moiety).

CAS Number193273-69-7
PubChem CID9852610
IUPAC NameN-[(2R)-1-[(3aR)-3a-benzyl-2-methyl-3-oxo-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]-1-oxo-3-phenylmethoxypropan-2-yl]-2-amino-2-methylpropanamide;(2R,3R)-2,3-dihydroxybutanedioic acid
Molecular FormulaC32H41N5O10
Molecular Weight655.7
Topological Polar Surface Area232
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count12
Rotatable Bond Count12
Heavy Atom Count47
Formal Charge0
Complexity1010
SMILES
CC(C)(C(=O)N[C@H](COCC1=CC=CC=C1)C(=O)N2CCC3=NN(C(=O)[C@@]3(C2)CC4=CC=CC=C4)C)N.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O
InChI
InChI=1S/C28H35N5O4.C4H6O6/c1-27(2,29)25(35)30-22(18-37-17-21-12-8-5-9-13-21)24(34)33-15-14-23-28(19-33,26(36)32(3)31-23)16-20-10-6-4-7-11-20;5-1(3(7)8)2(6)4(9)10/h4-13,22H,14-19,29H2,1-3H3,(H,30,35);1-2,5-6H,(H,7,8)(H,9,10)/t22-,28-;1-,2-/m11/s1
InChIKey
MJGRJCMGMFLOET-MYPSAZMDSA-N
Chemical Structure
2D Structure
2D structure of Capromorelin Tartrate
CAS: 193273-69-7
CID: 9852610
Formula: C32H41N5O10
MW: 655.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight655.7
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count12
Rotatable Bond Count12
Exact Mass655.28534252
Monoisotopic Mass655.28534252
Topological Polar Surface Area232 Ų
Heavy Atom Count47
Formal Charge0
Complexity1010
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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