N-[2-(3-methylthiophen-2-yl)ethyl]-3-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)propanamide
Chemical Structure Depiction of
N-[2-(3-methylthiophen-2-yl)ethyl]-3-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)propanamide
N-[2-(3-methylthiophen-2-yl)ethyl]-3-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)propanamide
Compound characteristics
| Compound ID: | E511-1235 |
| Compound Name: | N-[2-(3-methylthiophen-2-yl)ethyl]-3-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)propanamide |
| Molecular Weight: | 424.56 |
| Molecular Formula: | C18 H20 N2 O4 S3 |
| Smiles: | Cc1ccsc1CCNC(CCS(c1ccc2c(c1)NC(CS2)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4071 |
| logD: | 1.4071 |
| logSw: | -2.2952 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.155 |
| InChI Key: | NDELBEUOVQGRMD-UHFFFAOYSA-N |