Chemical ID: 4299239

COc1ccc(cc1)NC(=O)c2ccc(cc2)Oc3ccc(cc3)C(=O)Nc4ccc(cc4)OC
Chemical ID:
4299239
Name [?]:
N-(4-methoxyphenyl)-4-[4-[(4-methoxyphenyl)carbamoyl]phenoxy]-benzamide
SMILES [?]:
COc1ccc(cc1)NC(=O)c2ccc(cc2)Oc3ccc(cc3)C(=O)Nc4ccc(cc4)OC
InChi [?]:
InChI=1/C28H24N2O5/c1-33-23-15-7-21(8-16-23)29-27(31)19-3-11-25(12-4-19)35-26-13-5-20(6-14-26)28(32)30-22-9-17-24(34-2)18-10-22/h3-18H,1-2H3,(H,29,31)(H,30,32)
InChi Info:
AuxInfo=1/1/N:1,35,13,17,21,23,5,7,29,33,14,16,20,24,4,8,30,32,12,22,6,28,3,31,15,19,10,25,9,27,11,26,2,34,18/E:(1,2)(3,4,5,6)(7,8,9,10)(11,12,13,14)(15,16,17,18)(19,20)(21,22)(23,24)(25,26)(27,28)(29,30)(31,32)(33,34)/gE:(1,2)/rA:35nCOCCCCCCNCOCCCCCCOCCCCCCCONCCCCCCOC/rB:s1;s2;s3;d4;s5;d6;d3s7;s6;s9;d10;s10;s12;d13;s14;d15;d12s16;s15;s18;s19;d20;s21;d22;d19s23;s22;d25;s25;s27;s28;d29;s30;d31;d28s32;s31;s34;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C28H24N2O5
All Atoms:35
Heavy Atoms:35
Chiral Atoms:0
ZAP Information [?]
Total:11.4508
Area:728.086
Solvation:-6.75136
Coulombic:-65.3456
Bond Count [?]
All:38
Single:24
Double:14
Rotors:10
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:468.501
H-Bond Donors:2
H-Bond Acceptors:7
XLogP:5.27
LogP (Chemaxon):5.08

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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