2-({[(2H-1,3-benzodioxol-5-yl)methyl][(3-methylphenyl)methyl]amino}methyl)-N-[2-(morpholin-4-yl)ethyl]-1,3-oxazole-4-carboxamide
Chemical Structure Depiction of
2-({[(2H-1,3-benzodioxol-5-yl)methyl][(3-methylphenyl)methyl]amino}methyl)-N-[2-(morpholin-4-yl)ethyl]-1,3-oxazole-4-carboxamide
2-({[(2H-1,3-benzodioxol-5-yl)methyl][(3-methylphenyl)methyl]amino}methyl)-N-[2-(morpholin-4-yl)ethyl]-1,3-oxazole-4-carboxamide
Compound characteristics
| Compound ID: | V012-5489 |
| Compound Name: | 2-({[(2H-1,3-benzodioxol-5-yl)methyl][(3-methylphenyl)methyl]amino}methyl)-N-[2-(morpholin-4-yl)ethyl]-1,3-oxazole-4-carboxamide |
| Molecular Weight: | 492.57 |
| Molecular Formula: | C27 H32 N4 O5 |
| Salt: | not_available |
| Smiles: | Cc1cccc(CN(Cc2ccc3c(c2)OCO3)Cc2nc(co2)C(NCCN2CCOCC2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.8931 |
| logD: | 2.863 |
| logSw: | -3.0955 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.346 |
| InChI Key: | WBOKMULBANJCSD-UHFFFAOYSA-N |