Chemical ID: 5975955

CC(C)CNC(=O)c1cc(ccc1N(C)C)NC(=O)c2cccc(c2)Cl
Chemical ID:
5975955
Name [?]:
5-(3-chlorobenzoyl)amino-2-dimethylamino-N-isobutyl-benzamide
SMILES [?]:
CC(C)CNC(=O)c1cc(ccc1N(C)C)NC(=O)c2cccc(c2)Cl
InChi [?]:
InChI=1/C20H24ClN3O2/c1-13(2)12-22-20(26)17-11-16(8-9-18(17)24(3)4)23-19(25)14-6-5-7-15(21)10-14/h5-11,13H,12H2,1-4H3,(H,22,26)(H,23,25)
InChi Info:
AuxInfo=1/1/N:1,3,15,16,22,21,23,11,12,25,9,4,2,20,24,10,8,13,18,6,26,5,17,14,19,7/E:(1,2)(3,4)/rA:26nCCCCNCOCCCCCCNCCNCOCCCCCCCl/rB:s1;s2;s2;s4;s5;d6;s6;s8;d9;s10;d11;d8s12;s13;s14;s14;s10;s17;d18;s18;s20;d21;s22;d23;d20s24;s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H24ClN3O2
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:11.5043
Area:614.968
Solvation:-3.86994
Coulombic:-49.7624
Bond Count [?]
All:27
Single:19
Double:8
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:373.876
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:4.31
LogP (Chemaxon):4.0

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