N-(4-methylphenyl)-5-[(2-oxo-2-{[3-(pyrrolidin-1-yl)propyl]amino}ethoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(4-methylphenyl)-5-[(2-oxo-2-{[3-(pyrrolidin-1-yl)propyl]amino}ethoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
N-(4-methylphenyl)-5-[(2-oxo-2-{[3-(pyrrolidin-1-yl)propyl]amino}ethoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F500-0347 |
| Compound Name: | N-(4-methylphenyl)-5-[(2-oxo-2-{[3-(pyrrolidin-1-yl)propyl]amino}ethoxy)methyl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 417.53 |
| Molecular Formula: | C20 H27 N5 O3 S |
| Smiles: | Cc1ccc(cc1)NC(c1nnc(COCC(NCCCN2CCCC2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4101 |
| logD: | -1.6804 |
| logSw: | -2.2247 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.153 |
| InChI Key: | OUSSHWCLCCMWLZ-UHFFFAOYSA-N |