2-(7-methoxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)-N-[5-(oxolan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide
Chemical Structure Depiction of
2-(7-methoxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)-N-[5-(oxolan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide
2-(7-methoxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)-N-[5-(oxolan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide
Compound characteristics
| Compound ID: | Y042-3705 |
| Compound Name: | 2-(7-methoxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)-N-[5-(oxolan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide |
| Molecular Weight: | 401.44 |
| Molecular Formula: | C19 H19 N3 O5 S |
| Smiles: | CC1=C(CC(Nc2nnc(C3CCCO3)s2)=O)C(=O)Oc2cc(ccc12)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4143 |
| logD: | 2.3605 |
| logSw: | -3.1116 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.267 |
| InChI Key: | RQWLRZSDCNRDJC-AWEZNQCLSA-N |