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Chemical ID: 6409920
Chemical ID:
6409920
Name [?]:
N-[1-(4-methoxyphenyl)ethylideneamino]-4-(p-tolylmethoxy)benzamide
SMILES [?]:
Cc1ccc(cc1)COc2ccc(cc2)C(=O)NN=C(C)c3ccc(cc3)OC
InChi [?]:
InChI=1/C24H24N2O3/c1-17-4-6-19(7-5-17)16-29-23-14-10-21(11-15-23)24(27)26-25-18(2)20-8-12-22(28-3)13-9-20/h4-15H,16H2,1-3H3,(H,26,27)
InChi Info:
AuxInfo=1/1/N:1,21,29,3,7,4,6,23,27,12,14,24,26,11,15,8,2,20,5,22,13,25,10,16,19,18,17,28,9/E:(4,5)(6,7)(8,9)(10,11)(12,13)(14,15)/rA:29nCCCCCCCCOCCCCCCCONNCCCCCCCCOC/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;s9;s10;d11;s12;d13;d10s14;s13;d16;s16;s18;w19;s20;s20;s22;d23;s24;d25;d22s26;s25;s28;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C24H24N2O3 |
All Atoms: | 29 |
Heavy Atoms: | 29 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 10.6199 |
Area: | 660.978 |
Solvation: | -5.90452 |
Coulombic: | -35.8779 |
Bond Count [?]
All: | 31 |
Single: | 20 |
Double: | 11 |
Rotors: | 8 |
Chiral: | 1 |
Rigid Segments: | 7 |
Chemical Properties
Molecular Weight: | 388.459 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 5 |
XLogP: | 6.11 |
LogP (Chemaxon): | 4.61 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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