{4-[(3-fluoropyridin-4-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}(pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
{4-[(3-fluoropyridin-4-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}(pyrrolidin-1-yl)methanone
{4-[(3-fluoropyridin-4-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}(pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | M400-0344 |
| Compound Name: | {4-[(3-fluoropyridin-4-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}(pyrrolidin-1-yl)methanone |
| Molecular Weight: | 355.41 |
| Molecular Formula: | C20 H22 F N3 O2 |
| Smiles: | C1CCN(C1)C(c1ccc2c(CN(CCO2)Cc2ccncc2F)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2716 |
| logD: | 2.2674 |
| logSw: | -2.3991 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.447 |
| InChI Key: | MYWONKVYEBJQEU-UHFFFAOYSA-N |