5-(3-chlorophenyl)-3-(3,4-dimethoxyanilino)-4-methyl-1H-1lambda~6~,2-thiazole-1,1-dione
Chemical Structure Depiction of
5-(3-chlorophenyl)-3-(3,4-dimethoxyanilino)-4-methyl-1H-1lambda~6~,2-thiazole-1,1-dione
5-(3-chlorophenyl)-3-(3,4-dimethoxyanilino)-4-methyl-1H-1lambda~6~,2-thiazole-1,1-dione
Compound characteristics
Compound ID: | E013-2218 |
Compound Name: | 5-(3-chlorophenyl)-3-(3,4-dimethoxyanilino)-4-methyl-1H-1lambda~6~,2-thiazole-1,1-dione |
Molecular Weight: | 392.86 |
Molecular Formula: | C18 H17 Cl N2 O4 S |
Smiles: | CC1=C(c2cccc(c2)[Cl])S(N=C1Nc1ccc(c(c1)OC)OC)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.5329 |
logD: | 3.5288 |
logSw: | -3.9284 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 66.105 |
InChI Key: | ZIXNIBSQRXQUJH-UHFFFAOYSA-N |