2-{methyl[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]amino}-7-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
2-{methyl[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]amino}-7-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
2-{methyl[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]amino}-7-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | C885-4532 |
| Compound Name: | 2-{methyl[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]amino}-7-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 426.54 |
| Molecular Formula: | C21 H26 N6 O2 S |
| Smiles: | CCCC1=CC(N2C(=N1)SC(=N2)N(C)CC(N1CCN(CC1)c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3948 |
| logD: | 1.5913 |
| logSw: | -2.5853 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 60.733 |
| InChI Key: | MIFOHGHGUCIUDT-UHFFFAOYSA-N |