Chemical ID: 6525971

CN(CCc1ccc(c(c1)OC)OC)C(=O)Nc2ccc(c(c2)Cl)Cl
Chemical ID:
6525971
Name [?]:
3-(3,4-dichlorophenyl)-1-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-urea
SMILES [?]:
CN(CCc1ccc(c(c1)OC)OC)C(=O)Nc2ccc(c(c2)Cl)Cl
InChi [?]:
InChI=1/C18H20Cl2N2O3/c1-22(18(23)21-13-5-6-14(19)15(20)11-13)9-8-12-4-7-16(24-2)17(10-12)25-3/h4-7,10-11H,8-9H2,1-3H3,(H,21,23)
InChi Info:
AuxInfo=1/1/N:1,14,12,6,19,20,7,4,3,10,23,5,18,21,22,8,9,15,25,24,17,2,16,13,11/rA:25nCNCCCCCCCCOCOCCONCCCCCCClCl/rB:s1;s2;s3;s4;s5;d6;s7;d8;d5s9;s9;s11;s8;s13;s2;d15;s15;s17;s18;d19;s20;d21;d18s22;s22;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H20Cl2N2O3
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:9.54389
Area:604.162
Solvation:-5.56015
Coulombic:-45.3368
Bond Count [?]
All:26
Single:19
Double:7
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:383.268
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:3.73
LogP (Chemaxon):4.15

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