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15873-25-3 | L-Phenylalanine, N-benzoyl-, 2-naphthalenyl ester
CAS No: 15873-25-3 Catalog No: AG001QTY MDL No:MFCD00021607
Product Description
Catalog Number:
AG001QTY
Chemical Name:
L-Phenylalanine, N-benzoyl-, 2-naphthalenyl ester
CAS Number:
15873-25-3
Molecular Formula:
C26H21NO3
Molecular Weight:
395.4498
MDL Number:
MFCD00021607
IUPAC Name:
naphthalen-2-yl 2-benzamido-3-phenylpropanoate
InChI:
InChI=1S/C26H21NO3/c28-25(21-12-5-2-6-13-21)27-24(17-19-9-3-1-4-10-19)26(29)30-23-16-15-20-11-7-8-14-22(20)18-23/h1-16,18,24H,17H2,(H,27,28)
InChI Key:
NPPKNSHRAVHLHD-UHFFFAOYSA-N
SMILES:
O=C([C@@H](NC(=O)c1ccccc1)Cc1ccccc1)Oc1ccc2c(c1)cccc2
EC Number:
218-364-6
Properties
Complexity:
565
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
395.152g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
395.458g/mol
Monoisotopic Mass:
395.152g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
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