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Home > Imidazoles > 64869-50-7
64869-50-7 | L-Prolinamide, N-[(2-oxo-4-imidazolidinyl)carbonyl]-L-histidyl-
CAS No: 64869-50-7 Catalog No: AG006SGE MDL No:
Product Description
Catalog Number:
AG006SGE
Chemical Name:
L-Prolinamide, N-[(2-oxo-4-imidazolidinyl)carbonyl]-L-histidyl-
CAS Number:
64869-50-7
Molecular Formula:
C15H21N7O4
Molecular Weight:
363.3717
IUPAC Name:
N-[(2S)-1-[(2S)-2-carbamoylpyrrolidin-1-yl]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]-2-oxoimidazolidine-4-carboxamide
InChI:
InChI=1S/C15H21N7O4/c16-12(23)11-2-1-3-22(11)14(25)9(4-8-5-17-7-19-8)20-13(24)10-6-18-15(26)21-10/h5,7,9-11H,1-4,6H2,(H2,16,23)(H,17,19)(H,20,24)(H2,18,21,26)/t9-,10?,11-/m0/s1
InChI Key:
VEWVABCKPUSGFM-JRUYECLLSA-N
SMILES:
O=C1NCC(N1)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N)Cc1nc[nH]c1
Properties
Complexity:
599
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
363.166g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
5
Isotope Atom Count:
0
Molecular Weight:
363.378g/mol
Monoisotopic Mass:
363.166g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
162A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.9
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