Chemical ID: 7038761

COc1cccc(c1)C(NC(=O)c2cccc(c2)OC)NC(=O)c3cccc(c3)OC
Chemical ID:
7038761
Name [?]:
3-methoxy-N-[(3-methoxybenzoyl)amino-(3-methoxyphenyl)-methyl]-benzamide
SMILES [?]:
COc1cccc(c1)C(NC(=O)c2cccc(c2)OC)NC(=O)c3cccc(c3)OC
InChi [?]:
InChI=1/C24H24N2O5/c1-29-19-10-4-7-16(13-19)22(25-23(27)17-8-5-11-20(14-17)30-2)26-24(28)18-9-6-12-21(15-18)31-3/h4-15,22H,1-3H3,(H,25,27)(H,26,28)
InChi Info:
AuxInfo=1/1/N:1,20,31,5,15,26,6,14,25,4,16,27,8,18,29,7,13,24,3,17,28,9,11,22,10,21,12,23,2,19,30/E:(2,3)(5,6)(8,9)(11,12)(14,15)(17,18)(20,21)(23,24)(25,26)(27,28)(30,31)/gE:(1,2)/rA:31nCOCCCCCCCNCOCCCCCCOCNCOCCCCCCOC/rB:s1;s2;s3;d4;s5;d6;d3s7;s7;s9;s10;d11;s11;s13;d14;s15;d16;d13s17;s17;s19;s9;s21;d22;s22;s24;d25;s26;d27;d24s28;s28;s30;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C24H24N2O5
All Atoms:55
Heavy Atoms:31
Chiral Atoms:0
ZAP Information [?]
Total:9.20499
Area:671.704
Solvation:-7.58761
Coulombic:-65.5136
Bond Count [?]
All:33
Single:22
Double:11
Rotors:10
Chiral:0
Rigid Segments:9
Chemical Properties
Molecular Weight:420.458
H-Bond Donors:2
H-Bond Acceptors:7
XLogP:4.34
LogP (Chemaxon):3.07

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Descriptor Annotations

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