Chemical ID: 6472140

c1ccc(c(c1)C(=O)NCCCCO)NC(=O)c2ccc(cc2Cl)Cl
Chemical ID:
6472140
Name [?]:
2,4-dichloro-N-[2-(4-hydroxybutylcarbamoyl)phenyl]-benzamide
SMILES [?]:
c1ccc(c(c1)C(=O)NCCCCO)NC(=O)c2ccc(cc2Cl)Cl
InChi [?]:
InChI=1/C18H18Cl2N2O3/c19-12-7-8-13(15(20)11-12)18(25)22-16-6-2-1-5-14(16)17(24)21-9-3-4-10-23/h1-2,5-8,11,23H,3-4,9-10H2,(H,21,24)(H,22,25)
InChi Info:
AuxInfo=1/1/N:1,2,11,12,6,3,20,19,10,13,22,21,18,5,23,4,7,16,25,24,9,15,14,8,17/rA:25nCCCCCCCONCCCCONCOCCCCCCClCl/rB:s1;d2;s3;d4;d1s5;s5;d7;s7;s9;s10;s11;s12;s13;s4;s15;d16;s16;s18;d19;s20;d21;d18s22;s23;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H18Cl2N2O3
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:11.1668
Area:602.223
Solvation:-3.88874
Coulombic:-61.3596
Bond Count [?]
All:26
Single:18
Double:8
Rotors:9
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:381.253
H-Bond Donors:3
H-Bond Acceptors:5
XLogP:4.08
LogP (Chemaxon):3.75

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