3-[4-methyl-2-(4-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-N-[3-(3-methylpiperidin-1-yl)propyl]-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
3-[4-methyl-2-(4-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-N-[3-(3-methylpiperidin-1-yl)propyl]-1,2,4-oxadiazole-5-carboxamide
3-[4-methyl-2-(4-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-N-[3-(3-methylpiperidin-1-yl)propyl]-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | F486-1182 |
| Compound Name: | 3-[4-methyl-2-(4-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-N-[3-(3-methylpiperidin-1-yl)propyl]-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 467.53 |
| Molecular Formula: | C23 H29 N7 O4 |
| Smiles: | CC1CCCN(CCCNC(c2nc(C3C(N(C)C(N(c4ccc(C)cc4)N=3)=O)=O)no2)=O)C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3534 |
| logD: | -0.2182 |
| logSw: | -2.9135 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 102.13 |
| InChI Key: | HWCGDNKXDYUIBP-INIZCTEOSA-N |