Chemical ID: 4395402

Cc1ccc(cc1)NC(=O)C(=Cc2ccc(cc2)OC)c3ccccc3
Chemical ID:
4395402
Name [?]:
3-(4-methoxyphenyl)-2-phenyl-N-(p-tolyl)prop-2-enamide
SMILES [?]:
Cc1ccc(cc1)NC(=O)C(=Cc2ccc(cc2)OC)c3ccccc3
InChi [?]:
InChI=1/C23H21NO2/c1-17-8-12-20(13-9-17)24-23(25)22(19-6-4-3-5-7-19)16-18-10-14-21(26-2)15-11-18/h3-16H,1-2H3,(H,24,25)
InChi Info:
AuxInfo=1/1/N:1,20,24,23,25,22,26,3,7,14,18,4,6,15,17,12,2,13,21,5,16,11,9,8,10,19/E:(4,5)(6,7)(8,9)(10,11)(12,13)(14,15)/rA:26nCCCCCCCNCOCCCCCCCCOCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;d9;s9;w11;s12;s13;d14;s15;d16;d13s17;s16;s19;s11;s21;d22;s23;d24;d21s25;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C23H21NO2
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:10.8261
Area:567.442
Solvation:-3.35995
Coulombic:-32.1668
Bond Count [?]
All:28
Single:17
Double:11
Rotors:6
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:343.418
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:5.47
LogP (Chemaxon):5.4

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Descriptor Annotations

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