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921934-17-0 | L-Serine, D-phenylalanyl-N-methyl-O-(phenylmethyl)-
CAS No: 921934-17-0 Catalog No: AG006FTL MDL No:
Product Description
Catalog Number:
AG006FTL
Chemical Name:
L-Serine, D-phenylalanyl-N-methyl-O-(phenylmethyl)-
CAS Number:
921934-17-0
Molecular Formula:
C20H24N2O4
Molecular Weight:
356.4156
IUPAC Name:
(2S)-2-[[(2R)-2-amino-3-phenylpropanoyl]-methylamino]-3-phenylmethoxypropanoic acid
InChI:
InChI=1S/C20H24N2O4/c1-22(19(23)17(21)12-15-8-4-2-5-9-15)18(20(24)25)14-26-13-16-10-6-3-7-11-16/h2-11,17-18H,12-14,21H2,1H3,(H,24,25)/t17-,18+/m1/s1
InChI Key:
CZRXZORLSVQFFJ-MSOLQXFVSA-N
SMILES:
OC(=O)[C@@H](N(C(=O)[C@@H](Cc1ccccc1)N)C)COCc1ccccc1
Properties
Complexity:
445
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
356.174g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
356.422g/mol
Monoisotopic Mass:
356.174g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
92.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
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