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100930-00-5 | Glycinamide, L-leucyl-N-(2-naphthalenyl)- (9CI)
CAS No: 100930-00-5 Catalog No: AG000387 MDL No:
Product Description
Catalog Number:
AG000387
Chemical Name:
Glycinamide, L-leucyl-N-(2-naphthalenyl)- (9CI)
CAS Number:
100930-00-5
Molecular Formula:
C18H23N3O2
Molecular Weight:
313.3941
IUPAC Name:
(2S)-2-amino-4-methyl-N-[2-(naphthalen-2-ylamino)-2-oxoethyl]pentanamide
InChI:
InChI=1S/C18H23N3O2/c1-12(2)9-16(19)18(23)20-11-17(22)21-15-8-7-13-5-3-4-6-14(13)10-15/h3-8,10,12,16H,9,11,19H2,1-2H3,(H,20,23)(H,21,22)/t16-/m0/s1
InChI Key:
REBHTGLALGGOMA-INIZCTEOSA-N
SMILES:
CC(C[C@@H](C(=O)NCC(=O)Nc1ccc2c(c1)cccc2)N)C
Properties
Complexity:
411
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
313.179g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
313.401g/mol
Monoisotopic Mass:
313.179g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
84.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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