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Z-L-proline beta-naphthylamide

CAT: 0024-sc-296819Size: 1 gDry Ice: NoHazardous: No
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CAT#:0024-sc-296819Size:1 g
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CAS Number
86925-99-7

Chemical Information

Z-L-proline beta-naphthylamide
CAS Number86925-99-7
PubChem CID10109941
IUPAC Namebenzyl (2S)-2-(naphthalen-2-ylcarbamoyl)pyrrolidine-1-carboxylate
Molecular FormulaC23H22N2O3
Molecular Weight374.4
XLogP4.3
Topological Polar Surface Area58.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Heavy Atom Count28
Formal Charge0
Complexity546
SMILES
C1C[C@H](N(C1)C(=O)OCC2=CC=CC=C2)C(=O)NC3=CC4=CC=CC=C4C=C3
InChI
InChI=1S/C23H22N2O3/c26-22(24-20-13-12-18-9-4-5-10-19(18)15-20)21-11-6-14-25(21)23(27)28-16-17-7-2-1-3-8-17/h1-5,7-10,12-13,15,21H,6,11,14,16H2,(H,24,26)/t21-/m0/s1
InChIKey
JNQYOPCQZVPOCL-NRFANRHFSA-N
Chemical Structure
2D Structure
2D structure of Z-L-proline beta-naphthylamide
CAS: 86925-99-7
CID: 10109941
Formula: C23H22N2O3
MW: 374.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight374.4
XLogP34.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Exact Mass374.16304257
Monoisotopic Mass374.16304257
Topological Polar Surface Area58.6 Ų
Heavy Atom Count28
Formal Charge0
Complexity546
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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