200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 162149-58-8
162149-58-8 | L-Leucine, N-(7-nitro-2,1,3-benzoxadiazol-4-yl)-
CAS No: 162149-58-8 Catalog No: AG001SSW MDL No:
Product Description
Catalog Number:
AG001SSW
Chemical Name:
L-Leucine, N-(7-nitro-2,1,3-benzoxadiazol-4-yl)-
CAS Number:
162149-58-8
Molecular Formula:
C12H14N4O5
Molecular Weight:
294.2634
IUPAC Name:
(2S)-4-methyl-2-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]pentanoic acid
InChI:
InChI=1S/C12H14N4O5/c1-6(2)5-8(12(17)18)13-7-3-4-9(16(19)20)11-10(7)14-21-15-11/h3-4,6,8,13H,5H2,1-2H3,(H,17,18)/t8-/m0/s1
InChI Key:
XDDARMBTUCLRIN-QMMMGPOBSA-N
SMILES:
CC(C[C@@H](C(=O)O)Nc1ccc(c2c1non2)[N+](=O)[O-])C
Properties
Complexity:
400
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
294.096g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
294.267g/mol
Monoisotopic Mass:
294.096g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
134A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.