N-[3-(4-methylpiperazin-1-yl)propyl]-4-oxo-4-(pyrido[2,3-b][1,4]benzoxazepin-5(6H)-yl)butanamide
Chemical Structure Depiction of
N-[3-(4-methylpiperazin-1-yl)propyl]-4-oxo-4-(pyrido[2,3-b][1,4]benzoxazepin-5(6H)-yl)butanamide
N-[3-(4-methylpiperazin-1-yl)propyl]-4-oxo-4-(pyrido[2,3-b][1,4]benzoxazepin-5(6H)-yl)butanamide
Compound characteristics
| Compound ID: | E986-0153 |
| Compound Name: | N-[3-(4-methylpiperazin-1-yl)propyl]-4-oxo-4-(pyrido[2,3-b][1,4]benzoxazepin-5(6H)-yl)butanamide |
| Molecular Weight: | 437.54 |
| Molecular Formula: | C24 H31 N5 O3 |
| Smiles: | CN1CCN(CCCNC(CCC(N2Cc3ccccc3Oc3c2cccn3)=O)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 1.042 |
| logD: | -0.1625 |
| logSw: | -2.0595 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.92 |
| InChI Key: | WAOLZZFFANOGCK-UHFFFAOYSA-N |