200,000+ products from a single source!
sales@angenechem.com
82014-18-4 | L-Proline, 1-[N-[2-(benzoylamino)-3-phenylpropyl]-L-alanyl]-, (S)-
CAS No: 82014-18-4 Catalog No: AG004YUH MDL No:
Product Description
Catalog Number:
AG004YUH
Chemical Name:
L-Proline, 1-[N-[2-(benzoylamino)-3-phenylpropyl]-L-alanyl]-, (S)-
CAS Number:
82014-18-4
Molecular Formula:
C24H29N3O4
Molecular Weight:
423.5048
IUPAC Name:
(2S)-1-[(2S)-2-[(2-benzamido-3-phenylpropyl)amino]propanoyl]pyrrolidine-2-carboxylic acid
InChI:
InChI=1S/C24H29N3O4/c1-17(23(29)27-14-8-13-21(27)24(30)31)25-16-20(15-18-9-4-2-5-10-18)26-22(28)19-11-6-3-7-12-19/h2-7,9-12,17,20-21,25H,8,13-16H2,1H3,(H,26,28)(H,30,31)/t17-,20?,21-/m0/s1
InChI Key:
FDCFPWRPPNMSAU-ZPWCZAOQSA-N
SMILES:
C[C@@H](C(=O)N1CCC[C@H]1C(=O)O)NCC(NC(=O)c1ccccc1)Cc1ccccc1
Properties
Complexity:
614
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
423.216g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
423.513g/mol
Monoisotopic Mass:
423.216g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
98.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.