2-({[(2H-1,3-benzodioxol-5-yl)methyl][(3-phenoxyphenyl)methyl]amino}methyl)-N-[(pyridin-3-yl)methyl]-1,3-oxazole-4-carboxamide
Chemical Structure Depiction of
2-({[(2H-1,3-benzodioxol-5-yl)methyl][(3-phenoxyphenyl)methyl]amino}methyl)-N-[(pyridin-3-yl)methyl]-1,3-oxazole-4-carboxamide
2-({[(2H-1,3-benzodioxol-5-yl)methyl][(3-phenoxyphenyl)methyl]amino}methyl)-N-[(pyridin-3-yl)methyl]-1,3-oxazole-4-carboxamide
Compound characteristics
| Compound ID: | V010-7568 |
| Compound Name: | 2-({[(2H-1,3-benzodioxol-5-yl)methyl][(3-phenoxyphenyl)methyl]amino}methyl)-N-[(pyridin-3-yl)methyl]-1,3-oxazole-4-carboxamide |
| Molecular Weight: | 548.6 |
| Molecular Formula: | C32 H28 N4 O5 |
| Salt: | not_available |
| Smiles: | C(c1cccnc1)NC(c1coc(CN(Cc2cccc(c2)Oc2ccccc2)Cc2ccc3c(c2)OCO3)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6244 |
| logD: | 4.6232 |
| logSw: | -4.4451 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.879 |
| InChI Key: | XGYVVCGWFMWPOB-UHFFFAOYSA-N |