Chemical ID: 4161137

CCc1ccccc1NC(=O)COc2ccc(cc2)C(=O)Nc3cccc(c3C)Cl
Chemical ID:
4161137
Name [?]:
N-(3-chloro-2-methyl-phenyl)-4-[(2-ethylphenyl)carbamoylmethoxy]benzamide
SMILES [?]:
CCc1ccccc1NC(=O)COc2ccc(cc2)C(=O)Nc3cccc(c3C)Cl
InChi [?]:
InChI=1/C24H23ClN2O3/c1-3-17-7-4-5-9-22(17)26-23(28)15-30-19-13-11-18(12-14-19)24(29)27-21-10-6-8-20(25)16(21)2/h4-14H,3,15H2,1-2H3,(H,26,28)(H,27,29)
InChi Info:
AuxInfo=1/1/N:1,29,2,5,6,25,4,26,7,24,16,18,15,19,12,28,3,17,14,27,23,8,10,20,30,9,22,11,21,13/E:(11,12)(13,14)/rA:30nCCCCCCCCNCOCOCCCCCCCONCCCCCCCCl/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s9;d10;s10;s12;s13;s14;d15;s16;d17;d14s18;s17;d20;s20;s22;s23;d24;s25;d26;d23s27;s28;s27;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C24H23ClN2O3
All Atoms:30
Heavy Atoms:30
Chiral Atoms:0
ZAP Information [?]
Total:11.67
Area:667.326
Solvation:-5.01314
Coulombic:-51.2348
Bond Count [?]
All:32
Single:21
Double:11
Rotors:9
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:422.904
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:5.18
LogP (Chemaxon):4.48

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