2-(azepan-1-yl)-N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[(cyclopropanecarbonyl)amino]benzamide
Chemical Structure Depiction of
2-(azepan-1-yl)-N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[(cyclopropanecarbonyl)amino]benzamide
2-(azepan-1-yl)-N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[(cyclopropanecarbonyl)amino]benzamide
Compound characteristics
| Compound ID: | M535-1335 |
| Compound Name: | 2-(azepan-1-yl)-N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[(cyclopropanecarbonyl)amino]benzamide |
| Molecular Weight: | 435.52 |
| Molecular Formula: | C25 H29 N3 O4 |
| Smiles: | C1CCCN(CC1)c1cc(ccc1C(NCc1ccc2c(c1)OCO2)=O)NC(C1CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7647 |
| logD: | 4.7636 |
| logSw: | -4.5742 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.864 |
| InChI Key: | SOOPJMBRHPBHGD-UHFFFAOYSA-N |