5-(4-{[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]amino}-4-oxobutyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-(4-{[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]amino}-4-oxobutyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide
5-(4-{[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]amino}-4-oxobutyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F501-0776 |
| Compound Name: | 5-(4-{[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]amino}-4-oxobutyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 452.53 |
| Molecular Formula: | C23 H24 N4 O4 S |
| Smiles: | CC(c1ccc2c(c1)OCCO2)NC(CCCc1nnc(C(Nc2ccccc2)=O)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2627 |
| logD: | 2.2627 |
| logSw: | -3.0773 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.515 |
| InChI Key: | HCLHBTTZASMUGE-HNNXBMFYSA-N |