2-[([(2H-1,3-benzodioxol-5-yl)methyl]{[4-(propan-2-yl)phenyl]methyl}amino)methyl]-N-[2-(pyridin-2-yl)ethyl]-1,3-oxazole-4-carboxamide
Chemical Structure Depiction of
2-[([(2H-1,3-benzodioxol-5-yl)methyl]{[4-(propan-2-yl)phenyl]methyl}amino)methyl]-N-[2-(pyridin-2-yl)ethyl]-1,3-oxazole-4-carboxamide
2-[([(2H-1,3-benzodioxol-5-yl)methyl]{[4-(propan-2-yl)phenyl]methyl}amino)methyl]-N-[2-(pyridin-2-yl)ethyl]-1,3-oxazole-4-carboxamide
Compound characteristics
| Compound ID: | V020-9530 |
| Compound Name: | 2-[([(2H-1,3-benzodioxol-5-yl)methyl]{[4-(propan-2-yl)phenyl]methyl}amino)methyl]-N-[2-(pyridin-2-yl)ethyl]-1,3-oxazole-4-carboxamide |
| Molecular Weight: | 512.61 |
| Molecular Formula: | C30 H32 N4 O4 |
| Salt: | not_available |
| Smiles: | CC(C)c1ccc(CN(Cc2ccc3c(c2)OCO3)Cc2nc(co2)C(NCCc2ccccn2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.5379 |
| logD: | 4.5367 |
| logSw: | -4.2179 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.998 |
| InChI Key: | COTPXNBFZOOYFC-UHFFFAOYSA-N |