Chemical ID: 7252988

Cc1ccccc1C(=O)NCc2cccc(c2)Cl
Chemical ID:
7252988
Name [?]:
N-[(3-chlorophenyl)methyl]-2-methyl-benzamide
SMILES [?]:
Cc1ccccc1C(=O)NCc2cccc(c2)Cl
InChi [?]:
InChI=1/C15H14ClNO/c1-11-5-2-3-8-14(11)15(18)17-10-12-6-4-7-13(16)9-12/h2-9H,10H2,1H3,(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,4,5,14,3,13,15,6,17,11,2,12,16,7,8,18,10,9/rA:18nCCCCCCCCONCCCCCCCCl/rB:s1;s2;d3;s4;d5;d2s6;s7;d8;s8;s10;s11;s12;d13;s14;d15;d12s16;s16;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H14ClNO
All Atoms:32
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:9.92915
Area:459.603
Solvation:-1.56091
Coulombic:-25.3279
Bond Count [?]
All:19
Single:12
Double:7
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:259.73
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.2
LogP (Chemaxon):3.71

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue