2-(azepan-1-yl)-6-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
2-(azepan-1-yl)-6-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
2-(azepan-1-yl)-6-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G205-1037 |
| Compound Name: | 2-(azepan-1-yl)-6-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 487.02 |
| Molecular Formula: | C23 H27 Cl N6 O2 S |
| Smiles: | Cc1ccc(cc1N1CCN(CC1)C(C1=CN=C2N(C1=O)N=C(N1CCCCCC1)S2)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.1158 |
| logD: | 4.1147 |
| logSw: | -4.4469 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 60.765 |
| InChI Key: | BBTZSMBDIVEEIU-UHFFFAOYSA-N |