2-(azepan-1-yl)-5-(4-phenylpiperazine-1-carbonyl)-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Chemical Structure Depiction of
2-(azepan-1-yl)-5-(4-phenylpiperazine-1-carbonyl)-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
2-(azepan-1-yl)-5-(4-phenylpiperazine-1-carbonyl)-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Compound characteristics
| Compound ID: | F149-0528 |
| Compound Name: | 2-(azepan-1-yl)-5-(4-phenylpiperazine-1-carbonyl)-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one |
| Molecular Weight: | 438.55 |
| Molecular Formula: | C22 H26 N6 O2 S |
| Smiles: | C1CCCN(CC1)C1=NN2C(=CC(N=C2S1)=O)C(N1CCN(CC1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9662 |
| logD: | 1.2204 |
| logSw: | -3.2549 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 61.253 |
| InChI Key: | FHGFBNAZIBGKRJ-UHFFFAOYSA-N |