N-benzyl-3-{5-[(5-methylthiophen-2-yl)methyl]-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl}propanamide
Chemical Structure Depiction of
N-benzyl-3-{5-[(5-methylthiophen-2-yl)methyl]-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl}propanamide
N-benzyl-3-{5-[(5-methylthiophen-2-yl)methyl]-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl}propanamide
Compound characteristics
| Compound ID: | S586-0302 |
| Compound Name: | N-benzyl-3-{5-[(5-methylthiophen-2-yl)methyl]-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl}propanamide |
| Molecular Weight: | 395.53 |
| Molecular Formula: | C21 H25 N5 O S |
| Smiles: | Cc1ccc(CN2CCn3c(C2)c(CCC(NCc2ccccc2)=O)nn3)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.2302 |
| logD: | 0.895 |
| logSw: | -2.5251 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.933 |
| InChI Key: | RFGUQZYCLDJPAJ-UHFFFAOYSA-N |