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83792-80-7 | 1H-Benzimidazole-1-carboxamide, N-ethyl-2-[(phenylmethyl)amino]-
CAS No: 83792-80-7 Catalog No: AG004WL0 MDL No:
Product Description
Catalog Number:
AG004WL0
Chemical Name:
1H-Benzimidazole-1-carboxamide, N-ethyl-2-[(phenylmethyl)amino]-
CAS Number:
83792-80-7
Molecular Formula:
C17H18N4O
Molecular Weight:
294.3510
IUPAC Name:
2-(benzylamino)-N-ethylbenzimidazole-1-carboxamide
InChI:
InChI=1S/C17H18N4O/c1-2-18-17(22)21-15-11-7-6-10-14(15)20-16(21)19-12-13-8-4-3-5-9-13/h3-11H,2,12H2,1H3,(H,18,22)(H,19,20)
InChI Key:
JBIINGJIQVUOLA-UHFFFAOYSA-N
SMILES:
CCNC(=O)n1c(NCc2ccccc2)nc2c1cccc2
Properties
Complexity:
370
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.148g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
294.358g/mol
Monoisotopic Mass:
294.148g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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