Chemical ID: 4442436

CCCC(=O)Nc1ccccc1NC(=O)c2cccc(c2)Cl
Chemical ID:
4442436
Name [?]:
N-(2-butanoylaminophenyl)-3-chloro-benzamide
SMILES [?]:
CCCC(=O)Nc1ccccc1NC(=O)c2cccc(c2)Cl
InChi [?]:
InChI=1/C17H17ClN2O2/c1-2-6-16(21)19-14-9-3-4-10-15(14)20-17(22)12-7-5-8-13(18)11-12/h3-5,7-11H,2,6H2,1H3,(H,19,21)(H,20,22)
InChi Info:
AuxInfo=1/1/N:1,2,9,10,18,3,17,19,8,11,21,16,20,7,12,4,14,22,6,13,5,15/rA:22nCCCCONCCCCCCNCOCCCCCCCl/rB:s1;s2;s3;d4;s4;s6;s7;d8;s9;d10;d7s11;s12;s13;d14;s14;s16;d17;s18;d19;d16s20;s20;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H17ClN2O2
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:10.4602
Area:532.887
Solvation:-2.86196
Coulombic:-43.2361
Bond Count [?]
All:23
Single:15
Double:8
Rotors:7
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:316.782
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:3.69
LogP (Chemaxon):3.97

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