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Home > Nitro Compounds > 74569-70-3
74569-70-3 | L-Tyrosinamide, glycyl-N-(4-nitrophenyl)-
CAS No: 74569-70-3 Catalog No: AG005AQN MDL No:
Product Description
Catalog Number:
AG005AQN
Chemical Name:
L-Tyrosinamide, glycyl-N-(4-nitrophenyl)-
CAS Number:
74569-70-3
Molecular Formula:
C17H18N4O5
Molecular Weight:
358.3486
IUPAC Name:
(2S)-2-[(2-aminoacetyl)amino]-3-(4-hydroxyphenyl)-N-(4-nitrophenyl)propanamide
InChI:
InChI=1S/C17H18N4O5/c18-10-16(23)20-15(9-11-1-7-14(22)8-2-11)17(24)19-12-3-5-13(6-4-12)21(25)26/h1-8,15,22H,9-10,18H2,(H,19,24)(H,20,23)/t15-/m0/s1
InChI Key:
DZYRIXKIPKURGX-HNNXBMFYSA-N
SMILES:
NCC(=O)N[C@H](C(=O)Nc1ccc(cc1)[N+](=O)[O-])Cc1ccc(cc1)O
Properties
Complexity:
494
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
358.128g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
358.354g/mol
Monoisotopic Mass:
358.128g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
150A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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