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201854-09-3 | Pentanamide, 2,5-diamino-N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)-, hydrochloride (1:2), (2S)-
CAS No: 201854-09-3 Catalog No: AG0027WN MDL No:
Product Description
Catalog Number:
AG0027WN
Chemical Name:
Pentanamide, 2,5-diamino-N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)-, hydrochloride (1:2), (2S)-
CAS Number:
201854-09-3
IUPAC Name:
(2S)-2,5-diamino-N-(4-methyl-2-oxochromen-7-yl)pentanamide;dihydrochloride
InChI:
InChI=1S/C15H19N3O3.2ClH/c1-9-7-14(19)21-13-8-10(4-5-11(9)13)18-15(20)12(17)3-2-6-16;;/h4-5,7-8,12H,2-3,6,16-17H2,1H3,(H,18,20);2*1H/t12-;;/m0../s1
InChI Key:
CNRTYLCHCNDIJR-LTCKWSDVSA-N
Properties
Complexity:
436
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
361.096g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
5
Isotope Atom Count:
0
Molecular Weight:
362.251g/mol
Monoisotopic Mass:
361.096g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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