ethyl 4,5-dimethyl-2-{[2-methyl-1,1-dioxo-5-(thiophen-2-yl)-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-1,1-dioxo-5-(thiophen-2-yl)-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carbonyl]amino}thiophene-3-carboxylate
ethyl 4,5-dimethyl-2-{[2-methyl-1,1-dioxo-5-(thiophen-2-yl)-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carbonyl]amino}thiophene-3-carboxylate
Compound characteristics
| Compound ID: | E135-1192 |
| Compound Name: | ethyl 4,5-dimethyl-2-{[2-methyl-1,1-dioxo-5-(thiophen-2-yl)-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carbonyl]amino}thiophene-3-carboxylate |
| Molecular Weight: | 453.56 |
| Molecular Formula: | C18 H19 N3 O5 S3 |
| Smiles: | CCOC(c1c(C)c(C)sc1NC(C1=CC(c2cccs2)=NS(N1C)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3232 |
| logD: | -3.4671 |
| logSw: | -3.686 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.885 |
| InChI Key: | YQXMJWXIJJVHCZ-UHFFFAOYSA-N |