Chemical ID: 4348571

c1ccc(cc1)CCC(=O)Nc2cc(c(cc2Cl)Cl)Cl
Chemical ID:
4348571
Name [?]:
3-phenyl-N-(2,4,5-trichlorophenyl)-propanamide
SMILES [?]:
c1ccc(cc1)CCC(=O)Nc2cc(c(cc2Cl)Cl)Cl
InChi [?]:
InChI=1/C15H12Cl3NO/c16-11-8-13(18)14(9-12(11)17)19-15(20)7-6-10-4-2-1-3-5-10/h1-5,8-9H,6-7H2,(H,19,20)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,5,7,8,16,13,4,15,14,17,12,9,19,20,18,11,10/E:(2,3)(4,5)/rA:20nCCCCCCCCCONCCCCCCClClCl/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;d9;s9;s11;s12;d13;s14;d15;d12s16;s17;s15;s14;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H12Cl3NO
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:11.2442
Area:524.339
Solvation:-1.86428
Coulombic:-22.8025
Bond Count [?]
All:21
Single:14
Double:7
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:328.62
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.84
LogP (Chemaxon):4.52

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Descriptor Annotations

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