Chemical ID: 6156879

c1ccc(cc1)C=C(c2ccccc2)C(=O)Nc3cc(ccc3Cl)Cl
Chemical ID:
6156879
Name [?]:
N-(2,5-dichlorophenyl)-2,3-diphenyl-prop-2-enamide
SMILES [?]:
c1ccc(cc1)C=C(c2ccccc2)C(=O)Nc3cc(ccc3Cl)Cl
InChi [?]:
InChI=1/C21H15Cl2NO/c22-17-11-12-19(23)20(14-17)24-21(25)18(16-9-5-2-6-10-16)13-15-7-3-1-4-8-15/h1-14H,(H,24,25)
InChi Info:
AuxInfo=1/1/N:1,12,2,6,11,13,3,5,10,14,21,22,7,19,4,9,20,8,23,18,15,25,24,17,16/E:(3,4)(5,6)(7,8)(9,10)/rA:25nCCCCCCCCCCCCCCCONCCCCCCClCl/rB:s1;d2;s3;d4;d1s5;s4;w7;s8;s9;d10;s11;d12;d9s13;s8;d15;s15;s17;s18;d19;s20;d21;d18s22;s23;s20;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C21H15Cl2NO
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:12.2825
Area:557.518
Solvation:-1.65549
Coulombic:-27.2008
Bond Count [?]
All:27
Single:16
Double:11
Rotors:5
Chiral:1
Rigid Segments:5
Chemical Properties
Molecular Weight:368.255
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:6.37
LogP (Chemaxon):5.57

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