[4-(1-methyl-1H-pyrrole-2-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl](pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
[4-(1-methyl-1H-pyrrole-2-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl](pyrrolidin-1-yl)methanone
[4-(1-methyl-1H-pyrrole-2-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl](pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | M248-0672 |
| Compound Name: | [4-(1-methyl-1H-pyrrole-2-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl](pyrrolidin-1-yl)methanone |
| Molecular Weight: | 353.42 |
| Molecular Formula: | C20 H23 N3 O3 |
| Smiles: | Cn1cccc1C(N1CCOc2ccc(cc2C1)C(N1CCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5456 |
| logD: | 2.5456 |
| logSw: | -2.7127 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 44.262 |
| InChI Key: | DHUXLSFXNRABKK-UHFFFAOYSA-N |