3-[3-(benzylamino)-3-oxopropyl]-N-(3-methylphenyl)-6,7-dihydro[1,2,3]triazolo[1,5-a]pyrazine-5(4H)-carboxamide
Chemical Structure Depiction of
3-[3-(benzylamino)-3-oxopropyl]-N-(3-methylphenyl)-6,7-dihydro[1,2,3]triazolo[1,5-a]pyrazine-5(4H)-carboxamide
3-[3-(benzylamino)-3-oxopropyl]-N-(3-methylphenyl)-6,7-dihydro[1,2,3]triazolo[1,5-a]pyrazine-5(4H)-carboxamide
Compound characteristics
| Compound ID: | S586-1098 |
| Compound Name: | 3-[3-(benzylamino)-3-oxopropyl]-N-(3-methylphenyl)-6,7-dihydro[1,2,3]triazolo[1,5-a]pyrazine-5(4H)-carboxamide |
| Molecular Weight: | 418.5 |
| Molecular Formula: | C23 H26 N6 O2 |
| Smiles: | Cc1cccc(c1)NC(N1CCn2c(C1)c(CCC(NCc1ccccc1)=O)nn2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0637 |
| logD: | 2.0637 |
| logSw: | -2.873 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.651 |
| InChI Key: | DFRSIBWVEKJNMI-UHFFFAOYSA-N |