7-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-1,2,3,4-tetrahydro-12H-[1]benzothieno[2,3-d]pyrido[1,2-a]pyrimidin-12-one
Chemical Structure Depiction of
7-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-1,2,3,4-tetrahydro-12H-[1]benzothieno[2,3-d]pyrido[1,2-a]pyrimidin-12-one
7-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-1,2,3,4-tetrahydro-12H-[1]benzothieno[2,3-d]pyrido[1,2-a]pyrimidin-12-one
Compound characteristics
| Compound ID: | C367-0096 |
| Compound Name: | 7-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-1,2,3,4-tetrahydro-12H-[1]benzothieno[2,3-d]pyrido[1,2-a]pyrimidin-12-one |
| Molecular Weight: | 472.61 |
| Molecular Formula: | C27 H28 N4 O2 S |
| Smiles: | Cc1ccc(C)c(c1)N1CCN(CC1)C(C1=CC=CN2C1=Nc1c(C2=O)c2CCCCc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6796 |
| logD: | 4.6796 |
| logSw: | -4.6976 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 43.936 |
| InChI Key: | UJUMFXDGQRXWSP-UHFFFAOYSA-N |