Chemical ID: 5976003

CN(C)c1ccc(cc1C(=O)NCc2ccccc2)NC(=O)c3ccc(cc3)OC
Chemical ID:
5976003
Name [?]:
N-benzyl-2-dimethylamino-5-(4-methoxybenzoyl)amino-benzamide
SMILES [?]:
CN(C)c1ccc(cc1C(=O)NCc2ccccc2)NC(=O)c3ccc(cc3)OC
InChi [?]:
InChI=1/C24H25N3O3/c1-27(2)22-14-11-19(26-23(28)18-9-12-20(30-3)13-10-18)15-21(22)24(29)25-16-17-7-5-4-6-8-17/h4-15H,16H2,1-3H3,(H,25,29)(H,26,28)
InChi Info:
AuxInfo=1/1/N:1,3,30,17,16,18,15,19,24,28,6,25,27,5,8,13,14,23,7,26,9,4,21,10,12,20,2,22,11,29/E:(1,2)(5,6)(7,8)(9,10)(12,13)/rA:30nCNCCCCCCCCONCCCCCCCNCOCCCCCCOC/rB:s1;s2;s2;s4;d5;s6;d7;d4s8;s9;d10;s10;s12;s13;s14;d15;s16;d17;d14s18;s7;s20;d21;s21;s23;d24;s25;d26;d23s27;s26;s29;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C24H25N3O3
All Atoms:30
Heavy Atoms:30
Chiral Atoms:0
ZAP Information [?]
Total:11.092
Area:656.174
Solvation:-5.31235
Coulombic:-57.1709
Bond Count [?]
All:32
Single:21
Double:11
Rotors:9
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:403.474
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:4.23
LogP (Chemaxon):3.79

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