(3S,5S)-5-(7-methyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl)-1-[(3-methylthiophen-2-yl)methyl]pyrrolidin-3-ol
Chemical Structure Depiction of
(3S,5S)-5-(7-methyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl)-1-[(3-methylthiophen-2-yl)methyl]pyrrolidin-3-ol
(3S,5S)-5-(7-methyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl)-1-[(3-methylthiophen-2-yl)methyl]pyrrolidin-3-ol
Compound characteristics
| Compound ID: | S904-1698 |
| Compound Name: | (3S,5S)-5-(7-methyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl)-1-[(3-methylthiophen-2-yl)methyl]pyrrolidin-3-ol |
| Molecular Weight: | 333.45 |
| Molecular Formula: | C16 H23 N5 O S |
| Smiles: | Cc1ccsc1CN1C[C@H](C[C@H]1c1nnc2CN(C)CCn12)O |
| Stereo: | ABSOLUTE |
| logP: | 0.4851 |
| logD: | 0.4752 |
| logSw: | -1.3071 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.974 |
| InChI Key: | BSNXXBNKPYYPQX-OLZOCXBDSA-N |