1-ethyl-2-sulfanyl[1]benzopyrano[3,4-d]imidazol-4(1H)-one
Chemical Structure Depiction of
1-ethyl-2-sulfanyl[1]benzopyrano[3,4-d]imidazol-4(1H)-one
1-ethyl-2-sulfanyl[1]benzopyrano[3,4-d]imidazol-4(1H)-one
Compound characteristics
| Compound ID: | C301-6324 |
| Compound Name: | 1-ethyl-2-sulfanyl[1]benzopyrano[3,4-d]imidazol-4(1H)-one |
| Molecular Weight: | 246.28 |
| Molecular Formula: | C12 H10 N2 O2 S |
| Smiles: | CCn1c2c3ccccc3OC(c2nc1S)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2656 |
| logD: | 2.2589 |
| logSw: | -2.9247 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 30.8815 |
| InChI Key: | NJTKBEBIRSFURW-UHFFFAOYSA-N |