2-[2-oxo-6-(pyrrolidine-1-sulfonyl)-2,3-dihydro-1H-thieno[2,3-b][1,4]thiazin-1-yl]-N-({4-[(propan-2-yl)oxy]phenyl}methyl)acetamide
Chemical Structure Depiction of
2-[2-oxo-6-(pyrrolidine-1-sulfonyl)-2,3-dihydro-1H-thieno[2,3-b][1,4]thiazin-1-yl]-N-({4-[(propan-2-yl)oxy]phenyl}methyl)acetamide
2-[2-oxo-6-(pyrrolidine-1-sulfonyl)-2,3-dihydro-1H-thieno[2,3-b][1,4]thiazin-1-yl]-N-({4-[(propan-2-yl)oxy]phenyl}methyl)acetamide
Compound characteristics
| Compound ID: | G117-0612 |
| Compound Name: | 2-[2-oxo-6-(pyrrolidine-1-sulfonyl)-2,3-dihydro-1H-thieno[2,3-b][1,4]thiazin-1-yl]-N-({4-[(propan-2-yl)oxy]phenyl}methyl)acetamide |
| Molecular Weight: | 509.66 |
| Molecular Formula: | C22 H27 N3 O5 S3 |
| Smiles: | CC(C)Oc1ccc(CNC(CN2C(CSc3c2cc(s3)S(N2CCCC2)(=O)=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.0478 |
| logD: | 3.0478 |
| logSw: | -3.5396 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.988 |
| InChI Key: | TWOHGKSLAFRQJA-UHFFFAOYSA-N |