3-amino-2-ethoxy-5,6,7,8-tetrahydro-4H-1-benzothiopyran-4-one
Chemical Structure Depiction of
3-amino-2-ethoxy-5,6,7,8-tetrahydro-4H-1-benzothiopyran-4-one
3-amino-2-ethoxy-5,6,7,8-tetrahydro-4H-1-benzothiopyran-4-one
Compound characteristics
| Compound ID: | 8016-4606 |
| Compound Name: | 3-amino-2-ethoxy-5,6,7,8-tetrahydro-4H-1-benzothiopyran-4-one |
| Molecular Weight: | 225.31 |
| Molecular Formula: | C11 H15 N O2 S |
| Smiles: | CCOC1=C(C(C2CCCCC=2S1)=O)N |
| Stereo: | ACHIRAL |
| logP: | 2.4419 |
| logD: | 2.4363 |
| logSw: | -2.2637 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 42.769 |
| InChI Key: | UQISLRDUZYCMTE-UHFFFAOYSA-N |