4-amino-N-(2,6-dimethylphenyl)-3-(4-ethoxyphenyl)-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxamide
Chemical Structure Depiction of
4-amino-N-(2,6-dimethylphenyl)-3-(4-ethoxyphenyl)-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxamide
4-amino-N-(2,6-dimethylphenyl)-3-(4-ethoxyphenyl)-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxamide
Compound characteristics
Compound ID: | K286-0158 |
Compound Name: | 4-amino-N-(2,6-dimethylphenyl)-3-(4-ethoxyphenyl)-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxamide |
Molecular Weight: | 399.53 |
Molecular Formula: | C20 H21 N3 O2 S2 |
Smiles: | CCOc1ccc(cc1)N1C(=C(C(Nc2c(C)cccc2C)=O)SC1=S)N |
Stereo: | ACHIRAL |
logP: | 3.5971 |
logD: | 3.5971 |
logSw: | -3.7104 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 51.934 |
InChI Key: | VHQISQPUQSDUII-UHFFFAOYSA-N |