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13097-97-7 | Propanamide, 2-amino-N-[4-(2-phenyldiazenyl)phenyl]-, (2S)-
CAS No: 13097-97-7 Catalog No: AG000V75 MDL No:
Product Description
Catalog Number:
AG000V75
Chemical Name:
Propanamide, 2-amino-N-[4-(2-phenyldiazenyl)phenyl]-, (2S)-
CAS Number:
13097-97-7
Molecular Formula:
C15H16N4O
Molecular Weight:
268.3137
IUPAC Name:
(2S)-2-amino-N-(4-phenyldiazenylphenyl)propanamide
InChI:
InChI=1S/C15H16N4O/c1-11(16)15(20)17-12-7-9-14(10-8-12)19-18-13-5-3-2-4-6-13/h2-11H,16H2,1H3,(H,17,20)/t11-/m0/s1
InChI Key:
MILCPGNMPRJGQM-NSHDSACASA-N
SMILES:
C[C@@H](C(=O)Nc1ccc(cc1)N=Nc1ccccc1)N
Properties
Complexity:
331
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
268.132g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
268.32g/mol
Monoisotopic Mass:
268.132g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
79.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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