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823794-40-7 | Benzoic acid, 4-(hexahydropyrrolo[1,2-a]pyrazin-2(1H)-yl)-, hydrazide
CAS No: 823794-40-7 Catalog No: AG0053BN MDL No:
Product Description
Catalog Number:
AG0053BN
Chemical Name:
Benzoic acid, 4-(hexahydropyrrolo[1,2-a]pyrazin-2(1H)-yl)-, hydrazide
CAS Number:
823794-40-7
Molecular Formula:
C14H20N4O
Molecular Weight:
260.3348
IUPAC Name:
4-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)benzohydrazide
InChI:
InChI=1S/C14H20N4O/c15-16-14(19)11-3-5-12(6-4-11)18-9-8-17-7-1-2-13(17)10-18/h3-6,13H,1-2,7-10,15H2,(H,16,19)
InChI Key:
WHILVAWXRDGCOB-UHFFFAOYSA-N
SMILES:
NNC(=O)c1ccc(cc1)N1CCN2C(C1)CCC2
Properties
Complexity:
327
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.164g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
260.341g/mol
Monoisotopic Mass:
260.164g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
61.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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