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82364-91-8 | Benzamide, 2-chloro-N-[(cyclohexylamino)(cyclohexylimino)methyl]-
CAS No: 82364-91-8 Catalog No: AG00540W MDL No:
Product Description
Catalog Number:
AG00540W
Chemical Name:
Benzamide, 2-chloro-N-[(cyclohexylamino)(cyclohexylimino)methyl]-
CAS Number:
82364-91-8
Molecular Formula:
C20H28ClN3O
Molecular Weight:
361.9088
IUPAC Name:
2-chloro-N-(N,N'-dicyclohexylcarbamimidoyl)benzamide
InChI:
InChI=1S/C20H28ClN3O/c21-18-14-8-7-13-17(18)19(25)24-20(22-15-9-3-1-4-10-15)23-16-11-5-2-6-12-16/h7-8,13-16H,1-6,9-12H2,(H2,22,23,24,25)
InChI Key:
BYDQJILVEPKGBL-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1Cl)NC(=NC1CCCCC1)NC1CCCCC1
Properties
Complexity:
456
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
361.192g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
361.914g/mol
Monoisotopic Mass:
361.192g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
53.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7
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