{4-[(pyridin-2-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}(pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
{4-[(pyridin-2-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}(pyrrolidin-1-yl)methanone
{4-[(pyridin-2-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}(pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | M400-0369 |
| Compound Name: | {4-[(pyridin-2-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}(pyrrolidin-1-yl)methanone |
| Molecular Weight: | 337.42 |
| Molecular Formula: | C20 H23 N3 O2 |
| Smiles: | C1CCN(C1)C(c1ccc2c(CN(CCO2)Cc2ccccn2)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8958 |
| logD: | 1.8731 |
| logSw: | -2.3738 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.473 |
| InChI Key: | KCEUGMCHABPZSX-UHFFFAOYSA-N |