N-[2-(3-methylthiophen-2-yl)ethyl]-2-[3-oxo-6-(pyrrolidine-1-sulfonyl)-2,3-dihydro-4H-1,4-benzothiazin-4-yl]acetamide
Chemical Structure Depiction of
N-[2-(3-methylthiophen-2-yl)ethyl]-2-[3-oxo-6-(pyrrolidine-1-sulfonyl)-2,3-dihydro-4H-1,4-benzothiazin-4-yl]acetamide
N-[2-(3-methylthiophen-2-yl)ethyl]-2-[3-oxo-6-(pyrrolidine-1-sulfonyl)-2,3-dihydro-4H-1,4-benzothiazin-4-yl]acetamide
Compound characteristics
| Compound ID: | E589-2661 |
| Compound Name: | N-[2-(3-methylthiophen-2-yl)ethyl]-2-[3-oxo-6-(pyrrolidine-1-sulfonyl)-2,3-dihydro-4H-1,4-benzothiazin-4-yl]acetamide |
| Molecular Weight: | 479.64 |
| Molecular Formula: | C21 H25 N3 O4 S3 |
| Smiles: | Cc1ccsc1CCNC(CN1C(CSc2ccc(cc12)S(N1CCCC1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6426 |
| logD: | 2.6426 |
| logSw: | -3.1214 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.027 |
| InChI Key: | VCCVNSGMLZDOBP-UHFFFAOYSA-N |