N-(3-fluorophenyl)-5-(4-oxo-4-{[3-(pyrrolidin-1-yl)propyl]amino}butyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(3-fluorophenyl)-5-(4-oxo-4-{[3-(pyrrolidin-1-yl)propyl]amino}butyl)-1,3,4-thiadiazole-2-carboxamide
N-(3-fluorophenyl)-5-(4-oxo-4-{[3-(pyrrolidin-1-yl)propyl]amino}butyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F501-1123 |
| Compound Name: | N-(3-fluorophenyl)-5-(4-oxo-4-{[3-(pyrrolidin-1-yl)propyl]amino}butyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 419.52 |
| Molecular Formula: | C20 H26 F N5 O2 S |
| Smiles: | C(CC(NCCCN1CCCC1)=O)Cc1nnc(C(Nc2cccc(c2)F)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 1.7624 |
| logD: | -1.3281 |
| logSw: | -2.51 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.719 |
| InChI Key: | ITRMBXCJCMICPK-UHFFFAOYSA-N |