N-[3-(azepan-1-yl)propyl]-2-(4-methylpiperidin-1-yl)-7-oxo-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-[3-(azepan-1-yl)propyl]-2-(4-methylpiperidin-1-yl)-7-oxo-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxamide--hydrogen chloride (1/1)
N-[3-(azepan-1-yl)propyl]-2-(4-methylpiperidin-1-yl)-7-oxo-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | F149-0282 |
| Compound Name: | N-[3-(azepan-1-yl)propyl]-2-(4-methylpiperidin-1-yl)-7-oxo-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxamide--hydrogen chloride (1/1) |
| Molecular Weight: | 469.05 |
| Molecular Formula: | C21 H32 N6 O2 S |
| Salt: | HCl |
| Smiles: | CC1CCN(CC1)C1=NN2C(=CC(N=C2S1)=O)C(NCCCN1CCCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3769 |
| logD: | -0.1937 |
| logSw: | -2.5463 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.582 |
| InChI Key: | DLWQDFFGQRYYHE-UHFFFAOYSA-N |