3-(4-methoxyphenyl)-1-{3-[3-oxo-3-(pyrrolidin-1-yl)propyl]-6,7-dihydro[1,2,3]triazolo[1,5-a]pyrazin-5(4H)-yl}propan-1-one
Chemical Structure Depiction of
3-(4-methoxyphenyl)-1-{3-[3-oxo-3-(pyrrolidin-1-yl)propyl]-6,7-dihydro[1,2,3]triazolo[1,5-a]pyrazin-5(4H)-yl}propan-1-one
3-(4-methoxyphenyl)-1-{3-[3-oxo-3-(pyrrolidin-1-yl)propyl]-6,7-dihydro[1,2,3]triazolo[1,5-a]pyrazin-5(4H)-yl}propan-1-one
Compound characteristics
| Compound ID: | S586-0742 |
| Compound Name: | 3-(4-methoxyphenyl)-1-{3-[3-oxo-3-(pyrrolidin-1-yl)propyl]-6,7-dihydro[1,2,3]triazolo[1,5-a]pyrazin-5(4H)-yl}propan-1-one |
| Molecular Weight: | 411.5 |
| Molecular Formula: | C22 H29 N5 O3 |
| Smiles: | COc1ccc(CCC(N2CCn3c(C2)c(CCC(N2CCCC2)=O)nn3)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 1.3544 |
| logD: | 1.3543 |
| logSw: | -1.9165 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 67.134 |
| InChI Key: | NGNJUUDKMKBWAL-UHFFFAOYSA-N |