2-(2-methoxyethyl)-4-[4-(2-methylphenyl)piperazin-1-yl]-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidine
Chemical Structure Depiction of
2-(2-methoxyethyl)-4-[4-(2-methylphenyl)piperazin-1-yl]-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidine
2-(2-methoxyethyl)-4-[4-(2-methylphenyl)piperazin-1-yl]-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidine
Compound characteristics
| Compound ID: | S896-0044 |
| Compound Name: | 2-(2-methoxyethyl)-4-[4-(2-methylphenyl)piperazin-1-yl]-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidine |
| Molecular Weight: | 382.5 |
| Molecular Formula: | C22 H30 N4 O2 |
| Smiles: | Cc1ccccc1N1CCN(CC1)c1c2CCOCCc2nc(CCOC)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.8224 |
| logD: | 3.8187 |
| logSw: | -4.0316 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 44.148 |
| InChI Key: | QXRHVHLKWVZCLL-UHFFFAOYSA-N |