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Home > Nitro Compounds > 81928-67-8
81928-67-8 | L-Leucinamide, L-leucyl-N-(4-nitrophenyl)-
CAS No: 81928-67-8 Catalog No: AG0055W7 MDL No:
Product Description
Catalog Number:
AG0055W7
Chemical Name:
L-Leucinamide, L-leucyl-N-(4-nitrophenyl)-
CAS Number:
81928-67-8
Molecular Formula:
C18H28N4O4
Molecular Weight:
364.4393
IUPAC Name:
(2S)-2-amino-4-methyl-N-[(2S)-4-methyl-1-(4-nitroanilino)-1-oxopentan-2-yl]pentanamide
InChI:
InChI=1S/C18H28N4O4/c1-11(2)9-15(19)17(23)21-16(10-12(3)4)18(24)20-13-5-7-14(8-6-13)22(25)26/h5-8,11-12,15-16H,9-10,19H2,1-4H3,(H,20,24)(H,21,23)/t15-,16-/m0/s1
InChI Key:
ILCUGGFLWLUYEQ-HOTGVXAUSA-N
SMILES:
CC(C[C@@H](C(=O)Nc1ccc(cc1)[N+](=O)[O-])NC(=O)[C@H](CC(C)C)N)C
Properties
Complexity:
482
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
364.211g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
364.446g/mol
Monoisotopic Mass:
364.211g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
130A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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