2-(azepan-1-yl)-6-[4-(3-chlorophenyl)piperazine-1-carbonyl]-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
2-(azepan-1-yl)-6-[4-(3-chlorophenyl)piperazine-1-carbonyl]-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
2-(azepan-1-yl)-6-[4-(3-chlorophenyl)piperazine-1-carbonyl]-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G205-1034 |
| Compound Name: | 2-(azepan-1-yl)-6-[4-(3-chlorophenyl)piperazine-1-carbonyl]-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 473 |
| Molecular Formula: | C22 H25 Cl N6 O2 S |
| Smiles: | C1CCCN(CC1)C1=NN2C(=NC=C(C(N3CCN(CC3)c3cccc(c3)[Cl])=O)C2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.4168 |
| logD: | 3.4157 |
| logSw: | -3.648 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 61.066 |
| InChI Key: | AJVSHFJRSPQTKT-UHFFFAOYSA-N |