methyl 3-(2-{6-[(4-methoxyphenyl)methyl]-1,1-dioxo-1lambda~6~,2,6-thiadiazinan-2-yl}acetamido)thiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-(2-{6-[(4-methoxyphenyl)methyl]-1,1-dioxo-1lambda~6~,2,6-thiadiazinan-2-yl}acetamido)thiophene-2-carboxylate
methyl 3-(2-{6-[(4-methoxyphenyl)methyl]-1,1-dioxo-1lambda~6~,2,6-thiadiazinan-2-yl}acetamido)thiophene-2-carboxylate
Compound characteristics
| Compound ID: | G775-0454 |
| Compound Name: | methyl 3-(2-{6-[(4-methoxyphenyl)methyl]-1,1-dioxo-1lambda~6~,2,6-thiadiazinan-2-yl}acetamido)thiophene-2-carboxylate |
| Molecular Weight: | 453.53 |
| Molecular Formula: | C19 H23 N3 O6 S2 |
| Smiles: | COC(c1c(ccs1)NC(CN1CCCN(Cc2ccc(cc2)OC)S1(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8394 |
| logD: | 1.809 |
| logSw: | -2.5857 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.566 |
| InChI Key: | XOFXGETUWDYPPG-UHFFFAOYSA-N |