2-(4-methoxyphenyl)-4-(4-methylpiperazin-1-yl)-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidine
Chemical Structure Depiction of
2-(4-methoxyphenyl)-4-(4-methylpiperazin-1-yl)-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidine
2-(4-methoxyphenyl)-4-(4-methylpiperazin-1-yl)-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidine
Compound characteristics
| Compound ID: | S896-0132 |
| Compound Name: | 2-(4-methoxyphenyl)-4-(4-methylpiperazin-1-yl)-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidine |
| Molecular Weight: | 354.45 |
| Molecular Formula: | C20 H26 N4 O2 |
| Smiles: | CN1CCN(CC1)c1c2CCOCCc2nc(c2ccc(cc2)OC)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.5697 |
| logD: | 2.3895 |
| logSw: | -3.5767 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.605 |
| InChI Key: | UKJKLUVNYHPCKS-UHFFFAOYSA-N |