2-({bis[(2H-1,3-benzodioxol-5-yl)methyl]amino}methyl)-N-(butan-2-yl)-1,3-oxazole-4-carboxamide
Chemical Structure Depiction of
2-({bis[(2H-1,3-benzodioxol-5-yl)methyl]amino}methyl)-N-(butan-2-yl)-1,3-oxazole-4-carboxamide
2-({bis[(2H-1,3-benzodioxol-5-yl)methyl]amino}methyl)-N-(butan-2-yl)-1,3-oxazole-4-carboxamide
Compound characteristics
| Compound ID: | V018-0601 |
| Compound Name: | 2-({bis[(2H-1,3-benzodioxol-5-yl)methyl]amino}methyl)-N-(butan-2-yl)-1,3-oxazole-4-carboxamide |
| Molecular Weight: | 465.51 |
| Molecular Formula: | C25 H27 N3 O6 |
| Salt: | not_available |
| Smiles: | CCC(C)NC(c1coc(CN(Cc2ccc3c(c2)OCO3)Cc2ccc3c(c2)OCO3)n1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2809 |
| logD: | 3.2754 |
| logSw: | -3.519 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.442 |
| InChI Key: | VXCMKVLTHKMFMP-INIZCTEOSA-N |