Chemical ID: 5911160

c1ccc(cc1)CN(Cc2ccco2)C(=O)c3ccc(c(c3)Cl)Cl
Chemical ID:
5911160
Name [?]:
N-benzyl-3,4-dichloro-N-(2-furylmethyl)benzamide
SMILES [?]:
c1ccc(cc1)CN(Cc2ccco2)C(=O)c3ccc(c(c3)Cl)Cl
InChi [?]:
InChI=1/C19H15Cl2NO2/c20-17-9-8-15(11-18(17)21)19(23)22(13-16-7-4-10-24-16)12-14-5-2-1-3-6-14/h1-11H,12-13H2
InChi Info:
AuxInfo=1/0/N:1,2,6,12,3,5,11,18,19,13,22,7,9,4,17,10,20,21,15,24,23,8,16,14/E:(2,3)(5,6)/rA:24nCCCCCCCNCCCCCOCOCCCCCCClCl/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;s9;d10;s11;d12;s10s13;s8;d15;s15;s17;d18;s19;d20;d17s21;s21;s20;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H15Cl2NO2
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:10.5881
Area:550.147
Solvation:-3.16562
Coulombic:-27.0184
Bond Count [?]
All:26
Single:17
Double:9
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:360.233
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:4.93
LogP (Chemaxon):4.73

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