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139424-38-7 | L-Proline, 1-(2,2-dimethyl-1-oxopropyl)-, 2-methyl-2-[[(1-methylethyl)amino]carbonyl]hydrazide
CAS No: 139424-38-7 Catalog No: AG001AZP MDL No:
Product Description
Catalog Number:
AG001AZP
Chemical Name:
L-Proline, 1-(2,2-dimethyl-1-oxopropyl)-, 2-methyl-2-[[(1-methylethyl)amino]carbonyl]hydrazide
CAS Number:
139424-38-7
Molecular Formula:
C15H28N4O3
Molecular Weight:
312.4078
IUPAC Name:
(2R)-2-tert-butyl-2-[[methyl(propan-2-ylcarbamoyl)amino]carbamoyl]pyrrolidine-1-carboxylic acid
InChI:
InChI=1S/C15H28N4O4/c1-10(2)16-12(21)18(6)17-11(20)15(14(3,4)5)8-7-9-19(15)13(22)23/h10H,7-9H2,1-6H3,(H,16,21)(H,17,20)(H,22,23)/t15-/m0/s1
InChI Key:
KKHKJCNBVQWGKU-HNNXBMFYSA-N
SMILES:
CC(NC(=O)N(NC(=O)[C@@H]1CCCN1C(=O)C(C)(C)C)C)C
Properties
Complexity:
486
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
328.211g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
328.413g/mol
Monoisotopic Mass:
328.211g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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