2-(4-methoxyphenyl)-4-(pyrrolidin-1-yl)-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidine
Chemical Structure Depiction of
2-(4-methoxyphenyl)-4-(pyrrolidin-1-yl)-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidine
2-(4-methoxyphenyl)-4-(pyrrolidin-1-yl)-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidine
Compound characteristics
| Compound ID: | S896-0156 |
| Compound Name: | 2-(4-methoxyphenyl)-4-(pyrrolidin-1-yl)-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidine |
| Molecular Weight: | 325.41 |
| Molecular Formula: | C19 H23 N3 O2 |
| Smiles: | COc1ccc(cc1)c1nc2CCOCCc2c(n1)N1CCCC1 |
| Stereo: | ACHIRAL |
| logP: | 4.3351 |
| logD: | 4.3294 |
| logSw: | -4.2934 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 39.494 |
| InChI Key: | DQWNYWMMEXZJDX-UHFFFAOYSA-N |