Chemical ID: 5975962

CN(C)c1ccc(cc1C(=O)NC2CCCCC2)NC(=O)c3ccc(cc3)Cl
Chemical ID:
5975962
Name [?]:
5-(4-chlorobenzoyl)amino-N-cyclohexyl-2-dimethylamino-benzamide
SMILES [?]:
CN(C)c1ccc(cc1C(=O)NC2CCCCC2)NC(=O)c3ccc(cc3)Cl
InChi [?]:
InChI=1/C22H26ClN3O2/c1-26(2)20-13-12-18(25-21(27)15-8-10-16(23)11-9-15)14-19(20)22(28)24-17-6-4-3-5-7-17/h8-14,17H,3-7H2,1-2H3,(H,24,28)(H,25,27)
InChi Info:
AuxInfo=1/1/N:1,3,16,15,17,14,18,23,27,24,26,6,5,8,22,25,13,7,9,4,20,10,28,12,19,2,21,11/E:(1,2)(4,5)(6,7)(8,9)(10,11)/rA:28nCNCCCCCCCCONCCCCCCNCOCCCCCCCl/rB:s1;s2;s2;s4;d5;s6;d7;d4s8;s9;d10;s10;s12;s13;s14;s15;s16;s13s17;s7;s19;d20;s20;s22;d23;s24;d25;d22s26;s25;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C22H26ClN3O2
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:12.025
Area:632.595
Solvation:-3.78988
Coulombic:-49.9961
Bond Count [?]
All:30
Single:22
Double:8
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:399.914
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:5.06
LogP (Chemaxon):4.37

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