methyl 3-(2-{6-[(2-chlorophenyl)methyl]-1,1-dioxo-1lambda~6~,2,6-thiadiazinan-2-yl}acetamido)thiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-(2-{6-[(2-chlorophenyl)methyl]-1,1-dioxo-1lambda~6~,2,6-thiadiazinan-2-yl}acetamido)thiophene-2-carboxylate
methyl 3-(2-{6-[(2-chlorophenyl)methyl]-1,1-dioxo-1lambda~6~,2,6-thiadiazinan-2-yl}acetamido)thiophene-2-carboxylate
Compound characteristics
| Compound ID: | G775-0401 |
| Compound Name: | methyl 3-(2-{6-[(2-chlorophenyl)methyl]-1,1-dioxo-1lambda~6~,2,6-thiadiazinan-2-yl}acetamido)thiophene-2-carboxylate |
| Molecular Weight: | 457.95 |
| Molecular Formula: | C18 H20 Cl N3 O5 S2 |
| Smiles: | COC(c1c(ccs1)NC(CN1CCCN(Cc2ccccc2[Cl])S1(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4729 |
| logD: | 2.4424 |
| logSw: | -3.1313 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.022 |
| InChI Key: | PSXVTLGVAUHMBK-UHFFFAOYSA-N |