N-[3-(4-methylpiperazin-1-yl)propyl]-1-(5-oxo-7-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-2-yl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-[3-(4-methylpiperazin-1-yl)propyl]-1-(5-oxo-7-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-2-yl)piperidine-4-carboxamide
N-[3-(4-methylpiperazin-1-yl)propyl]-1-(5-oxo-7-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-2-yl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | C885-4731 |
| Compound Name: | N-[3-(4-methylpiperazin-1-yl)propyl]-1-(5-oxo-7-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-2-yl)piperidine-4-carboxamide |
| Molecular Weight: | 461.63 |
| Molecular Formula: | C22 H35 N7 O2 S |
| Smiles: | CCCC1=CC(N2C(=N1)SC(=N2)N1CCC(CC1)C(NCCCN1CCN(C)CC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0882 |
| logD: | -0.1163 |
| logSw: | -1.92 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.292 |
| InChI Key: | HRHBJSIAMODRSN-UHFFFAOYSA-N |