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201982-92-5 | Butanamide, 2-amino-N-(4-methoxy-2-naphthalenyl)-3-methyl-, hydrochloride (1:1), (2S)-
CAS No: 201982-92-5 Catalog No: AG0027YC MDL No:
Product Description
Catalog Number:
AG0027YC
Chemical Name:
Butanamide, 2-amino-N-(4-methoxy-2-naphthalenyl)-3-methyl-, hydrochloride (1:1), (2S)-
CAS Number:
201982-92-5
Molecular Formula:
C16H21ClN2O2
Molecular Weight:
308.8031
IUPAC Name:
(2S)-2-amino-N-(4-methoxynaphthalen-2-yl)-3-methylbutanamide;hydrochloride
InChI:
InChI=1S/C16H20N2O2.ClH/c1-10(2)15(17)16(19)18-12-8-11-6-4-5-7-13(11)14(9-12)20-3;/h4-10,15H,17H2,1-3H3,(H,18,19);1H/t15-;/m0./s1
InChI Key:
HJGVSUAPGMEBMM-RSAXXLAASA-N
SMILES:
COc1cc(NC(=O)[C@H](C(C)C)N)cc2c1cccc2.Cl
Properties
Complexity:
332
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
308.129g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
308.806g/mol
Monoisotopic Mass:
308.129g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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