3-[3-(benzylamino)-3-oxopropyl]-N-[(4-methoxyphenyl)methyl]-6,7-dihydro[1,2,3]triazolo[1,5-a]pyrazine-5(4H)-carboxamide
Chemical Structure Depiction of
3-[3-(benzylamino)-3-oxopropyl]-N-[(4-methoxyphenyl)methyl]-6,7-dihydro[1,2,3]triazolo[1,5-a]pyrazine-5(4H)-carboxamide
3-[3-(benzylamino)-3-oxopropyl]-N-[(4-methoxyphenyl)methyl]-6,7-dihydro[1,2,3]triazolo[1,5-a]pyrazine-5(4H)-carboxamide
Compound characteristics
| Compound ID: | S586-1096 |
| Compound Name: | 3-[3-(benzylamino)-3-oxopropyl]-N-[(4-methoxyphenyl)methyl]-6,7-dihydro[1,2,3]triazolo[1,5-a]pyrazine-5(4H)-carboxamide |
| Molecular Weight: | 448.52 |
| Molecular Formula: | C24 H28 N6 O3 |
| Smiles: | COc1ccc(CNC(N2CCn3c(C2)c(CCC(NCc2ccccc2)=O)nn3)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 1.3136 |
| logD: | 1.3136 |
| logSw: | -1.987 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.517 |
| InChI Key: | RQSLRZDHEQQUJZ-UHFFFAOYSA-N |