N-(2-[(2-methylpropyl)amino]-2-oxo-1-{1-[4-(trifluoromethyl)benzoyl]piperidin-4-yl}ethyl)-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-(2-[(2-methylpropyl)amino]-2-oxo-1-{1-[4-(trifluoromethyl)benzoyl]piperidin-4-yl}ethyl)-2H-1,3-benzodioxole-5-carboxamide
N-(2-[(2-methylpropyl)amino]-2-oxo-1-{1-[4-(trifluoromethyl)benzoyl]piperidin-4-yl}ethyl)-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | V009-2538 |
| Compound Name: | N-(2-[(2-methylpropyl)amino]-2-oxo-1-{1-[4-(trifluoromethyl)benzoyl]piperidin-4-yl}ethyl)-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 533.55 |
| Molecular Formula: | C27 H30 F3 N3 O5 |
| Smiles: | CC(C)CNC(C(C1CCN(CC1)C(c1ccc(cc1)C(F)(F)F)=O)NC(c1ccc2c(c1)OCO2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9944 |
| logD: | 3.9944 |
| logSw: | -4.2009 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.452 |
| InChI Key: | BOUIIHBZIPNGNQ-QHCPKHFHSA-N |