methyl 3-(2-{6-[(2-methylphenyl)methyl]-1,1-dioxo-1lambda~6~,2,6-thiadiazinan-2-yl}acetamido)thiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-(2-{6-[(2-methylphenyl)methyl]-1,1-dioxo-1lambda~6~,2,6-thiadiazinan-2-yl}acetamido)thiophene-2-carboxylate
methyl 3-(2-{6-[(2-methylphenyl)methyl]-1,1-dioxo-1lambda~6~,2,6-thiadiazinan-2-yl}acetamido)thiophene-2-carboxylate
Compound characteristics
| Compound ID: | G775-0507 |
| Compound Name: | methyl 3-(2-{6-[(2-methylphenyl)methyl]-1,1-dioxo-1lambda~6~,2,6-thiadiazinan-2-yl}acetamido)thiophene-2-carboxylate |
| Molecular Weight: | 437.54 |
| Molecular Formula: | C19 H23 N3 O5 S2 |
| Smiles: | Cc1ccccc1CN1CCCN(CC(Nc2ccsc2C(=O)OC)=O)S1(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6076 |
| logD: | 2.5771 |
| logSw: | -2.9288 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.022 |
| InChI Key: | BJFZAJDVTBYDHU-UHFFFAOYSA-N |