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114499-71-7 | Benzamide, 2-[(2-chloroacetyl)amino]-N-(3-pyridinylmethyl)-
CAS No: 114499-71-7 Catalog No: AG000EKN MDL No:
Product Description
Catalog Number:
AG000EKN
Chemical Name:
Benzamide, 2-[(2-chloroacetyl)amino]-N-(3-pyridinylmethyl)-
CAS Number:
114499-71-7
Molecular Formula:
C15H14ClN3O2
Molecular Weight:
303.7436
IUPAC Name:
2-[(2-chloroacetyl)amino]-N-(pyridin-3-ylmethyl)benzamide
InChI:
InChI=1S/C15H14ClN3O2/c16-8-14(20)19-13-6-2-1-5-12(13)15(21)18-10-11-4-3-7-17-9-11/h1-7,9H,8,10H2,(H,18,21)(H,19,20)
InChI Key:
XIUNOBHSOQJGGN-UHFFFAOYSA-N
SMILES:
ClCC(=O)Nc1ccccc1C(=O)NCc1cccnc1
Properties
Complexity:
365
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
303.077g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
303.746g/mol
Monoisotopic Mass:
303.077g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
71.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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