Chemical ID: 6356305

CC(c1ccccc1)NC(=O)c2cc(nc3c2cccc3)c4ccc(cc4)OC
Chemical ID:
6356305
Name [?]:
2-(4-methoxyphenyl)-N-(1-phenylethyl)quinoline-4-carboxamide
SMILES [?]:
CC(c1ccccc1)NC(=O)c2cc(nc3c2cccc3)c4ccc(cc4)OC
InChi [?]:
InChI=1/C25H22N2O2/c1-17(18-8-4-3-5-9-18)26-25(28)22-16-24(19-12-14-20(29-2)15-13-19)27-23-11-7-6-10-21(22)23/h3-17H,1-2H3,(H,26,28)
InChi Info:
AuxInfo=1/1/N:1,29,6,5,7,19,20,4,8,18,21,23,27,24,26,13,2,3,22,25,17,12,16,14,10,9,15,11,28/E:(4,5)(8,9)(12,13)(14,15)/rA:29cCCCCCCCCNCOCCCNCCCCCCCCCCCCOC/rB:s1;s2;s3;d4;s5;d6;d3s7;s2;s9;d10;s10;s12;d13;s14;d15;d12s16;s17;d18;s19;s16d20;s14;s22;d23;s24;d25;d22s26;s25;s28;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C25H22N2O2
All Atoms:29
Heavy Atoms:29
Chiral Atoms:1
ZAP Information [?]
Total:11.7356
Area:615.238
Solvation:-3.64539
Coulombic:-37.9389
Bond Count [?]
All:32
Single:20
Double:12
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:382.454
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:5.71
LogP (Chemaxon):5.05

Name Annotations

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Descriptor Annotations

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