6-methyl-2-oxo-2H-1-benzopyran-3-carbothioamide
Chemical Structure Depiction of
6-methyl-2-oxo-2H-1-benzopyran-3-carbothioamide
6-methyl-2-oxo-2H-1-benzopyran-3-carbothioamide
Compound characteristics
| Compound ID: | C201-0393 |
| Compound Name: | 6-methyl-2-oxo-2H-1-benzopyran-3-carbothioamide |
| Molecular Weight: | 219.26 |
| Molecular Formula: | C11 H9 N O2 S |
| Smiles: | Cc1ccc2c(C=C(C(=O)O2)C(N)=S)c1 |
| Stereo: | ACHIRAL |
| logP: | 1.7085 |
| logD: | 1.7085 |
| logSw: | -2.2572 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 40.613 |
| InChI Key: | RYJVIDJFLWMXFI-UHFFFAOYSA-N |