4-{1-[(2H-1,3-benzodioxole-5-carbonyl)amino]-2-[(butan-2-yl)amino]-2-oxoethyl}-N-(4-methylphenyl)piperidine-1-carboxamide
Chemical Structure Depiction of
4-{1-[(2H-1,3-benzodioxole-5-carbonyl)amino]-2-[(butan-2-yl)amino]-2-oxoethyl}-N-(4-methylphenyl)piperidine-1-carboxamide
4-{1-[(2H-1,3-benzodioxole-5-carbonyl)amino]-2-[(butan-2-yl)amino]-2-oxoethyl}-N-(4-methylphenyl)piperidine-1-carboxamide
Compound characteristics
| Compound ID: | V013-8767 |
| Compound Name: | 4-{1-[(2H-1,3-benzodioxole-5-carbonyl)amino]-2-[(butan-2-yl)amino]-2-oxoethyl}-N-(4-methylphenyl)piperidine-1-carboxamide |
| Molecular Weight: | 494.59 |
| Molecular Formula: | C27 H34 N4 O5 |
| Smiles: | CCC(C)NC(C(C1CCN(CC1)C(Nc1ccc(C)cc1)=O)NC(c1ccc2c(c1)OCO2)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.0166 |
| logD: | 4.0166 |
| logSw: | -3.9756 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.715 |
| InChI Key: | FHQMTQXSJPRMIM-UHFFFAOYSA-N |