3-acetyl-5,6,7,8-tetrahydro-4H-1,4-benzothiazine-2-carboxylic acid
Chemical Structure Depiction of
3-acetyl-5,6,7,8-tetrahydro-4H-1,4-benzothiazine-2-carboxylic acid
3-acetyl-5,6,7,8-tetrahydro-4H-1,4-benzothiazine-2-carboxylic acid
Compound characteristics
| Compound ID: | 8017-6384 |
| Compound Name: | 3-acetyl-5,6,7,8-tetrahydro-4H-1,4-benzothiazine-2-carboxylic acid |
| Molecular Weight: | 239.29 |
| Molecular Formula: | C11 H13 N O3 S |
| Smiles: | CC(C1=C(C(O)=O)SC2CCCCC=2N1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0643 |
| logD: | -2.4931 |
| logSw: | -1.6203 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.681 |
| InChI Key: | MCZAXOXJNFRUEU-UHFFFAOYSA-N |