3-{5-[(3-methylthiophen-2-yl)methyl]-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl}-1-(pyrrolidin-1-yl)propan-1-one
Chemical Structure Depiction of
3-{5-[(3-methylthiophen-2-yl)methyl]-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl}-1-(pyrrolidin-1-yl)propan-1-one
3-{5-[(3-methylthiophen-2-yl)methyl]-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl}-1-(pyrrolidin-1-yl)propan-1-one
Compound characteristics
| Compound ID: | S586-0127 |
| Compound Name: | 3-{5-[(3-methylthiophen-2-yl)methyl]-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl}-1-(pyrrolidin-1-yl)propan-1-one |
| Molecular Weight: | 359.49 |
| Molecular Formula: | C18 H25 N5 O S |
| Smiles: | Cc1ccsc1CN1CCn2c(C1)c(CCC(N1CCCC1)=O)nn2 |
| Stereo: | ACHIRAL |
| logP: | 1.4999 |
| logD: | 1.1622 |
| logSw: | -2.1135 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.22 |
| InChI Key: | ZYQFUBZHAFVMGE-UHFFFAOYSA-N |