ethyl 3-{[5-(3,4-dimethylphenyl)-4-methyl-1,1-dioxo-1H-1lambda~6~,2-thiazol-3-yl]amino}benzoate
Chemical Structure Depiction of
ethyl 3-{[5-(3,4-dimethylphenyl)-4-methyl-1,1-dioxo-1H-1lambda~6~,2-thiazol-3-yl]amino}benzoate
ethyl 3-{[5-(3,4-dimethylphenyl)-4-methyl-1,1-dioxo-1H-1lambda~6~,2-thiazol-3-yl]amino}benzoate
Compound characteristics
| Compound ID: | E013-0409 |
| Compound Name: | ethyl 3-{[5-(3,4-dimethylphenyl)-4-methyl-1,1-dioxo-1H-1lambda~6~,2-thiazol-3-yl]amino}benzoate |
| Molecular Weight: | 398.48 |
| Molecular Formula: | C21 H22 N2 O4 S |
| Smiles: | CCOC(c1cccc(c1)NC1C(C)=C(c2ccc(C)c(C)c2)S(N=1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1031 |
| logD: | 5.1024 |
| logSw: | -4.8888 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.598 |
| InChI Key: | CPNSJRDZSMNJQY-UHFFFAOYSA-N |