Chemical ID: 6332119

CCOc1ccc(cc1)C=NNc2nc(cs2)c3ccc(cc3Cl)Cl
Chemical ID:
6332119
Name [?]:
4-(2,4-dichlorophenyl)-N-[(4-ethoxyphenyl)methyleneamino]thiazol-2-amine
SMILES [?]:
CCOc1ccc(cc1)C=NNc2nc(cs2)c3ccc(cc3Cl)Cl
InChi [?]:
InChI=1/C18H15Cl2N3OS/c1-2-24-14-6-3-12(4-7-14)10-21-23-18-22-17(11-25-18)15-8-5-13(19)9-16(15)20/h3-11H,2H2,1H3,(H,22,23)
InChi Info:
AuxInfo=1/1/N:1,2,6,8,20,5,9,19,22,10,16,7,21,4,18,23,15,13,25,24,11,14,12,3,17/E:(3,4)(6,7)/rA:25nCCOCCCCCCCNNCNCCSCCCCCCClCl/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s7;w10;s11;s12;d13;s14;d15;s13s16;s15;s18;d19;s20;d21;d18s22;s23;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H15Cl2N3OS
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:11.505
Area:598.724
Solvation:-3.46312
Coulombic:-25.4678
Bond Count [?]
All:27
Single:18
Double:9
Rotors:6
Chiral:1
Rigid Segments:5
Chemical Properties
Molecular Weight:392.303
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:6.76
LogP (Chemaxon):6.27

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