4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(2-methoxyethyl)-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidine
Chemical Structure Depiction of
4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(2-methoxyethyl)-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidine
4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(2-methoxyethyl)-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidine
Compound characteristics
| Compound ID: | S896-0034 |
| Compound Name: | 4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(2-methoxyethyl)-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidine |
| Molecular Weight: | 396.53 |
| Molecular Formula: | C23 H32 N4 O2 |
| Smiles: | Cc1cccc(c1C)N1CCN(CC1)c1c2CCOCCc2nc(CCOC)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.3235 |
| logD: | 4.3197 |
| logSw: | -4.3679 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 44.148 |
| InChI Key: | MQOUXGWWEBABDH-UHFFFAOYSA-N |