Home Aminos 2-Pyrazinecarboxamide, N-[(1S)-2-[[(1S)-1-hydroxy-3-methylbutyl]amino]-2-oxo-1-(phenylmethyl)ethyl]-

2-Pyrazinecarboxamide, N-[(1S)-2-[[(1S)-1-hydroxy-3-methylbutyl]amino]-2-oxo-1-(phenylmethyl)ethyl]-

CAS No.:
289472-81-7
Catalog Number:
AG002X5R
Molecular Formula:
C19H24N4O3
Molecular Weight:
356.4189
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Product Description
Catalog Number:
AG002X5R
Chemical Name:
2-Pyrazinecarboxamide, N-[(1S)-2-[[(1S)-1-hydroxy-3-methylbutyl]amino]-2-oxo-1-(phenylmethyl)ethyl]-
CAS Number:
289472-81-7
Molecular Formula:
C19H24N4O3
Molecular Weight:
356.4189
MDL Number:
MFCD26940315
IUPAC Name:
N-[(2S)-1-[[(1S)-1-hydroxy-3-methylbutyl]amino]-1-oxo-3-phenylpropan-2-yl]pyrazine-2-carboxamide
InChI:
InChI=1S/C19H24N4O3/c1-13(2)10-17(24)23-18(25)15(11-14-6-4-3-5-7-14)22-19(26)16-12-20-8-9-21-16/h3-9,12-13,15,17,24H,10-11H2,1-2H3,(H,22,26)(H,23,25)/t15-,17-/m0/s1
InChI Key:
NEIDLJIPMZVISC-RDJZCZTQSA-N
SMILES:
CC(C[C@@H](NC(=O)[C@@H](NC(=O)c1cnccn1)Cc1ccccc1)O)C
Properties
Complexity:
452  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
356.185g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
356.426g/mol
Monoisotopic Mass:
356.185g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties