Chemical ID: 4155290

COc1cc(ccc1OCc2ccccc2)C=CC(=O)NCc3ccccc3
Chemical ID:
4155290
Name [?]:
N-benzyl-3-(4-benzyloxy-3-methoxy-phenyl)-prop-2-enamide
SMILES [?]:
COc1cc(ccc1OCc2ccccc2)C=CC(=O)NCc3ccccc3
InChi [?]:
InChI=1/C24H23NO3/c1-27-23-16-19(12-14-22(23)28-18-21-10-6-3-7-11-21)13-15-24(26)25-17-20-8-4-2-5-9-20/h2-16H,17-18H2,1H3,(H,25,26)
InChi Info:
AuxInfo=1/1/N:1,26,14,25,27,13,15,24,28,12,16,6,17,7,18,4,22,10,5,23,11,8,3,19,21,20,2,9/E:(4,5)(6,7)(8,9)(10,11)/rA:28nCOCCCCCCOCCCCCCCCCCONCCCCCCC/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s9;s10;s11;d12;s13;d14;d11s15;s5;w17;s18;d19;s19;s21;s22;s23;d24;s25;d26;d23s27;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C24H23NO3
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:9.86071
Area:630.119
Solvation:-5.89226
Coulombic:-39.3105
Bond Count [?]
All:30
Single:19
Double:11
Rotors:9
Chiral:1
Rigid Segments:8
Chemical Properties
Molecular Weight:373.444
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:4.68
LogP (Chemaxon):4.58

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