4-(8-methyl-5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)-N-[(thiophen-2-yl)methyl]butanamide
Chemical Structure Depiction of
4-(8-methyl-5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)-N-[(thiophen-2-yl)methyl]butanamide
4-(8-methyl-5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)-N-[(thiophen-2-yl)methyl]butanamide
Compound characteristics
| Compound ID: | E645-2260 |
| Compound Name: | 4-(8-methyl-5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)-N-[(thiophen-2-yl)methyl]butanamide |
| Molecular Weight: | 407.49 |
| Molecular Formula: | C22 H21 N3 O3 S |
| Smiles: | Cc1ccc2c(c1)N(CCCC(NCc1cccs1)=O)C(c1cccnc1O2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.167 |
| logD: | 3.167 |
| logSw: | -3.592 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58 |
| InChI Key: | UJKXIJMVMLIWLQ-UHFFFAOYSA-N |