N-({1-[(2,5-dimethylphenyl)methyl]piperidin-4-yl}methyl)-3-(4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
N-({1-[(2,5-dimethylphenyl)methyl]piperidin-4-yl}methyl)-3-(4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)-1,2,4-oxadiazole-5-carboxamide
N-({1-[(2,5-dimethylphenyl)methyl]piperidin-4-yl}methyl)-3-(4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | M338-0284 |
| Compound Name: | N-({1-[(2,5-dimethylphenyl)methyl]piperidin-4-yl}methyl)-3-(4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 489.57 |
| Molecular Formula: | C27 H31 N5 O4 |
| Smiles: | Cc1ccc(C)c(CN2CCC(CC2)CNC(c2nc(c3ccc4c(c3)OCC(N4C)=O)no2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.0035 |
| logD: | 1.7263 |
| logSw: | -4.153 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.929 |
| InChI Key: | CCQODGLPLNITPQ-UHFFFAOYSA-N |