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17337-71-2 | L-Phenylalaninamide, N-[(phenylmethoxy)carbonyl]-L-norvalyl-
CAS No: 17337-71-2 Catalog No: AG001YUX MDL No:
Product Description
Catalog Number:
AG001YUX
Chemical Name:
L-Phenylalaninamide, N-[(phenylmethoxy)carbonyl]-L-norvalyl-
CAS Number:
17337-71-2
Molecular Formula:
C22H27N3O4
Molecular Weight:
397.4675
IUPAC Name:
benzyl N-[1-[(1-amino-1-oxo-3-phenylpropan-2-yl)amino]-1-oxopentan-2-yl]carbamate
InChI:
InChI=1S/C22H27N3O4/c1-2-9-18(25-22(28)29-15-17-12-7-4-8-13-17)21(27)24-19(20(23)26)14-16-10-5-3-6-11-16/h3-8,10-13,18-19H,2,9,14-15H2,1H3,(H2,23,26)(H,24,27)(H,25,28)
InChI Key:
GIKKFYSYHXJPJI-UHFFFAOYSA-N
SMILES:
CCC[C@@H](C(=O)N[C@H](C(=O)N)Cc1ccccc1)NC(=O)OCc1ccccc1
NSC Number:
333480
Properties
Complexity:
528
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
397.2g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
397.475g/mol
Monoisotopic Mass:
397.2g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
111A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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