6-methyl-4-oxo-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]-4H-1-benzopyran-2-carboxamide
Chemical Structure Depiction of
6-methyl-4-oxo-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]-4H-1-benzopyran-2-carboxamide
6-methyl-4-oxo-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]-4H-1-benzopyran-2-carboxamide
Compound characteristics
| Compound ID: | D103-1043 |
| Compound Name: | 6-methyl-4-oxo-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]-4H-1-benzopyran-2-carboxamide |
| Molecular Weight: | 329.38 |
| Molecular Formula: | C16 H15 N3 O3 S |
| Smiles: | [H]N(C(C1=CC(c2cc(C)ccc2O1)=O)=O)c1nnc(C(C)C)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.6634 |
| logD: | 2.6554 |
| logSw: | -3.8939 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.693 |
| InChI Key: | LNHMNXUQTQNNLM-UHFFFAOYSA-N |