Chemical ID: 6544280

CN(C)c1cccc(c1)NC(=O)Nc2ccc(c(c2)Cl)Cl
Chemical ID:
6544280
Name [?]:
3-(3,4-dichlorophenyl)-1-(3-dimethylaminophenyl)-urea
SMILES [?]:
CN(C)c1cccc(c1)NC(=O)Nc2ccc(c(c2)Cl)Cl
InChi [?]:
InChI=1/C15H15Cl2N3O/c1-20(2)12-5-3-4-10(8-12)18-15(21)19-11-6-7-13(16)14(17)9-11/h3-9H,1-2H3,(H2,18,19,21)
InChi Info:
AuxInfo=1/1/N:1,3,6,7,5,15,16,9,19,8,14,4,17,18,11,21,20,10,13,2,12/E:(1,2)/rA:21nCNCCCCCCCNCONCCCCCCClCl/rB:s1;s2;s2;s4;d5;s6;d7;d4s8;s8;s10;d11;s11;s13;s14;d15;s16;d17;d14s18;s18;s17;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H15Cl2N3O
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:10.6958
Area:519.71
Solvation:-2.29691
Coulombic:-41.5302
Bond Count [?]
All:22
Single:15
Double:7
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:324.205
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:3.94
LogP (Chemaxon):4.81

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