2-(5,7-dimethoxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide
Chemical Structure Depiction of
2-(5,7-dimethoxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide
2-(5,7-dimethoxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide
Compound characteristics
| Compound ID: | Y042-3707 |
| Compound Name: | 2-(5,7-dimethoxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide |
| Molecular Weight: | 403.46 |
| Molecular Formula: | C19 H21 N3 O5 S |
| Smiles: | CC(C)c1nnc(NC(CC2=C(C)c3c(cc(cc3OC2=O)OC)OC)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.0184 |
| logD: | 2.967 |
| logSw: | -3.3482 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.757 |
| InChI Key: | XALPMYNCFUOXLM-UHFFFAOYSA-N |