Chemical ID: 5817939

Cc1ccccc1COc2ccc(cc2)C=C(C#N)C(=O)Nc3ccccc3
Chemical ID:
5817939
Name [?]:
2-cyano-3-[4-(o-tolylmethoxy)phenyl]-N-phenyl-prop-2-enamide
SMILES [?]:
Cc1ccccc1COc2ccc(cc2)C=C(C#N)C(=O)Nc3ccccc3
InChi [?]:
InChI=1/C24H20N2O2/c1-18-7-5-6-8-20(18)17-28-23-13-11-19(12-14-23)15-21(16-25)24(27)26-22-9-3-2-4-10-22/h2-15H,17H2,1H3,(H,26,27)
InChi Info:
AuxInfo=1/1/N:1,26,25,27,4,5,3,6,24,28,12,14,11,15,16,18,8,2,13,7,17,23,10,20,19,22,21,9/E:(3,4)(9,10)(11,12)(13,14)/rA:28nCCCCCCCCOCCCCCCCCCNCONCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;s9;s10;d11;s12;d13;d10s14;s13;w16;s17;t18;s17;d20;s20;s22;s23;d24;s25;d26;d23s27;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C24H20N2O2
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:11.9033
Area:615.81
Solvation:-3.49194
Coulombic:-35.6011
Bond Count [?]
All:30
Single:18
Double:11
Rotors:7
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:368.428
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:5.98
LogP (Chemaxon):5.53

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