ethyl 4,5-dimethyl-2-{[2-methyl-5-(4-methylphenyl)-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carbonyl]amino}thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 4,5-dimethyl-2-{[2-methyl-5-(4-methylphenyl)-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carbonyl]amino}thiophene-3-carboxylate
ethyl 4,5-dimethyl-2-{[2-methyl-5-(4-methylphenyl)-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carbonyl]amino}thiophene-3-carboxylate
Compound characteristics
| Compound ID: | E135-0193 |
| Compound Name: | ethyl 4,5-dimethyl-2-{[2-methyl-5-(4-methylphenyl)-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carbonyl]amino}thiophene-3-carboxylate |
| Molecular Weight: | 461.56 |
| Molecular Formula: | C21 H23 N3 O5 S2 |
| Smiles: | CCOC(c1c(C)c(C)sc1NC(C1=CC(c2ccc(C)cc2)=NS(N1C)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9274 |
| logD: | -2.8398 |
| logSw: | -4.207 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.867 |
| InChI Key: | LWKKAIBQSLSTQN-UHFFFAOYSA-N |