4-[4-(2-fluorophenyl)piperazin-1-yl]-2-(2-methoxyethyl)-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidine
Chemical Structure Depiction of
4-[4-(2-fluorophenyl)piperazin-1-yl]-2-(2-methoxyethyl)-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidine
4-[4-(2-fluorophenyl)piperazin-1-yl]-2-(2-methoxyethyl)-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidine
Compound characteristics
| Compound ID: | S896-0030 |
| Compound Name: | 4-[4-(2-fluorophenyl)piperazin-1-yl]-2-(2-methoxyethyl)-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidine |
| Molecular Weight: | 386.47 |
| Molecular Formula: | C21 H27 F N4 O2 |
| Smiles: | COCCc1nc2CCOCCc2c(n1)N1CCN(CC1)c1ccccc1F |
| Stereo: | ACHIRAL |
| logP: | 3.3784 |
| logD: | 3.3747 |
| logSw: | -3.5738 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 44.148 |
| InChI Key: | MXCFKYZHAXXKLK-UHFFFAOYSA-N |