N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-1-oxo-1H-2-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-1-oxo-1H-2-benzopyran-3-carboxamide
N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-1-oxo-1H-2-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | 7656-0806 |
| Compound Name: | N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-1-oxo-1H-2-benzopyran-3-carboxamide |
| Molecular Weight: | 333.39 |
| Molecular Formula: | C14 H11 N3 O3 S2 |
| Smiles: | CCSc1nnc(NC(C2=Cc3ccccc3C(=O)O2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.4649 |
| logD: | 3.3109 |
| logSw: | -3.8832 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.643 |
| InChI Key: | FVYBQCFWAIOJRB-UHFFFAOYSA-N |