N-(4-fluorophenyl)-5-[(2-oxo-2-{[3-(pyrrolidin-1-yl)butyl]amino}ethoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(4-fluorophenyl)-5-[(2-oxo-2-{[3-(pyrrolidin-1-yl)butyl]amino}ethoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
N-(4-fluorophenyl)-5-[(2-oxo-2-{[3-(pyrrolidin-1-yl)butyl]amino}ethoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F500-0741 |
| Compound Name: | N-(4-fluorophenyl)-5-[(2-oxo-2-{[3-(pyrrolidin-1-yl)butyl]amino}ethoxy)methyl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 435.52 |
| Molecular Formula: | C20 H26 F N5 O3 S |
| Smiles: | CC(CCNC(COCc1nnc(C(Nc2ccc(cc2)F)=O)s1)=O)N1CCCC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1855 |
| logD: | -2.2672 |
| logSw: | -2.2192 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.811 |
| InChI Key: | AGHLUKUBPZLFQK-AWEZNQCLSA-N |