[(3S)-3-methyl-7-[(morpholin-4-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl](1-methyl-1H-pyrrol-2-yl)methanone
Chemical Structure Depiction of
[(3S)-3-methyl-7-[(morpholin-4-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl](1-methyl-1H-pyrrol-2-yl)methanone
[(3S)-3-methyl-7-[(morpholin-4-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl](1-methyl-1H-pyrrol-2-yl)methanone
Compound characteristics
| Compound ID: | S978-0264 |
| Compound Name: | [(3S)-3-methyl-7-[(morpholin-4-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl](1-methyl-1H-pyrrol-2-yl)methanone |
| Molecular Weight: | 369.46 |
| Molecular Formula: | C21 H27 N3 O3 |
| Smiles: | C[C@H]1COc2ccc(CN3CCOCC3)cc2CN1C(c1cccn1C)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.7753 |
| logD: | 2.7134 |
| logSw: | -2.8963 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.672 |
| InChI Key: | XDZBCXVBIQSUAK-INIZCTEOSA-N |