Chemical ID: 7198285

Cc1c([nH+]c(s1)N)c2ccc(cc2Cl)Cl
Chemical ID:
7198285
Name [?]:
4-(2,4-dichlorophenyl)-5-methyl-3H-thiazol-2-amine
SMILES [?]:
Cc1c([nH+]c(s1)N)c2ccc(cc2Cl)Cl
InChi [?]:
InChI=1/C10H8Cl2N2S/c1-5-9(14-10(13)15-5)7-3-2-6(11)4-8(7)12/h2-4H,1H3,(H2,13,14)/p+1
InChi Info:
AuxInfo=1/1/N:1,10,9,12,2,11,8,13,3,5,15,14,7,4,6/rA:15nCCCN+CSNCCCCCCClCl/rB:s1;d2;s3;d4;s2s5;s5;s3;s8;d9;s10;d11;d8s12;s13;s11;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H9Cl2N2S+
All Atoms:24
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:-21.479
Area:414.199
Solvation:-31.834
Coulombic:-10.6672
Bond Count [?]
All:16
Single:11
Double:5
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:260.163
H-Bond Donors:2
H-Bond Acceptors:1
XLogP:3.29
LogP (Chemaxon):3.64

Name Annotations

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Descriptor Annotations

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