5-[3-(1,3-dimethyl-1H-pyrazol-5-yl)prop-2-enoyl]-4-hydroxy-2H-1,3-thiazine-2,6(3H)-dione
Chemical Structure Depiction of
5-[3-(1,3-dimethyl-1H-pyrazol-5-yl)prop-2-enoyl]-4-hydroxy-2H-1,3-thiazine-2,6(3H)-dione
5-[3-(1,3-dimethyl-1H-pyrazol-5-yl)prop-2-enoyl]-4-hydroxy-2H-1,3-thiazine-2,6(3H)-dione
Compound characteristics
| Compound ID: | Y505-2853 |
| Compound Name: | 5-[3-(1,3-dimethyl-1H-pyrazol-5-yl)prop-2-enoyl]-4-hydroxy-2H-1,3-thiazine-2,6(3H)-dione |
| Molecular Weight: | 293.3 |
| Molecular Formula: | C12 H11 N3 O4 S |
| Smiles: | Cc1cc(/C=C/C(C2=C(NC(=O)SC2=O)O)=O)n(C)n1 |
| Stereo: | ACHIRAL |
| logP: | -0.1585 |
| logD: | -6.3055 |
| logSw: | -2.111 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.042 |
| InChI Key: | WUXXRXDUSIMMAO-UHFFFAOYSA-N |