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102579-47-5 | Z-GLY-PHE-GLY-ALDEHYDE SEMICARBAZONE
CAS No: 102579-47-5 Catalog No: AG008UXB MDL No:
Product Description
Catalog Number:
AG008UXB
Chemical Name:
Z-GLY-PHE-GLY-ALDEHYDE SEMICARBAZONE
CAS Number:
102579-47-5
IUPAC Name:
benzyl N-[2-[[(2S)-1-[2-(carbamoylhydrazinylidene)ethylamino]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]carbamate
InChI:
InChI=1S/C22H26N6O5/c23-21(31)28-26-12-11-24-20(30)18(13-16-7-3-1-4-8-16)27-19(29)14-25-22(32)33-15-17-9-5-2-6-10-17/h1-10,12,18H,11,13-15H2,(H,24,30)(H,25,32)(H,27,29)(H3,23,28,31)/t18-/m0/s1
InChI Key:
LQKMBGDXENCOTJ-SFHVURJKSA-N
Properties
Complexity:
674
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
454.196g/mol
Formal Charge:
0
Heavy Atom Count:
33
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
5
Isotope Atom Count:
0
Molecular Weight:
454.487g/mol
Monoisotopic Mass:
454.196g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
164A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
0.9
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