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Chemical ID: 6883741
Chemical ID:
6883741
Name [?]:
N-(2-methoxy-5-methyl-phenyl)-4-(1-naphthylcarbamoylmethoxy)benzamide
SMILES [?]:
Cc1ccc(c(c1)NC(=O)c2ccc(cc2)OCC(=O)Nc3cccc4c3cccc4)OC
InChi [?]:
InChI=1/C27H24N2O4/c1-18-10-15-25(32-2)24(16-18)29-27(31)20-11-13-21(14-12-20)33-17-26(30)28-23-9-5-7-19-6-3-4-8-22(19)23/h3-16H,17H2,1-2H3,(H,28,30)(H,29,31)
InChi Info:
AuxInfo=1/1/N:1,33,30,29,24,31,25,28,23,3,12,16,13,15,4,7,18,2,26,11,14,27,22,6,5,19,9,21,8,20,10,32,17/E:(11,12)(13,14)/rA:33nCCCCCCCNCOCCCCCCOCCONCCCCCCCCCCOC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;d9;s9;s11;d12;s13;d14;d11s15;s14;s17;s18;d19;s19;s21;s22;d23;s24;d25;d22s26;s27;d28;s29;s26d30;s5;s32;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C27H24N2O4 |
All Atoms: | 57 |
Heavy Atoms: | 33 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 11.0054 |
Area: | 690.564 |
Solvation: | -6.25868 |
Coulombic: | -58.9524 |
Bond Count [?]
All: | 36 |
Single: | 23 |
Double: | 13 |
Rotors: | 9 |
Chiral: | 0 |
Rigid Segments: | 7 |
Chemical Properties
Molecular Weight: | 440.491 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 6 |
XLogP: | 5.26 |
LogP (Chemaxon): | 5.15 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
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