3-(2-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)-N-[2-(3-methylthiophen-2-yl)ethyl]propanamide
Chemical Structure Depiction of
3-(2-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)-N-[2-(3-methylthiophen-2-yl)ethyl]propanamide
3-(2-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)-N-[2-(3-methylthiophen-2-yl)ethyl]propanamide
Compound characteristics
| Compound ID: | E589-1021 |
| Compound Name: | 3-(2-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)-N-[2-(3-methylthiophen-2-yl)ethyl]propanamide |
| Molecular Weight: | 452.61 |
| Molecular Formula: | C20 H24 N2 O4 S3 |
| Smiles: | CCC1C(Nc2cc(ccc2S1)S(CCC(NCCc1c(C)ccs1)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7452 |
| logD: | 2.7452 |
| logSw: | -3.2197 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.212 |
| InChI Key: | MFKJJCITSVXEBY-MRXNPFEDSA-N |