4-[7-(3-methoxybenzene-1-sulfonyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-N,N-dimethylpiperidine-1-carboxamide
Chemical Structure Depiction of
4-[7-(3-methoxybenzene-1-sulfonyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-N,N-dimethylpiperidine-1-carboxamide
4-[7-(3-methoxybenzene-1-sulfonyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-N,N-dimethylpiperidine-1-carboxamide
Compound characteristics
| Compound ID: | S903-1497 |
| Compound Name: | 4-[7-(3-methoxybenzene-1-sulfonyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-N,N-dimethylpiperidine-1-carboxamide |
| Molecular Weight: | 448.54 |
| Molecular Formula: | C20 H28 N6 O4 S |
| Smiles: | CN(C)C(N1CCC(CC1)c1nnc2CN(CCn12)S(c1cccc(c1)OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0099 |
| logD: | 0.9634 |
| logSw: | -2.4324 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 81.734 |
| InChI Key: | QNYYXWNNRFEWAJ-UHFFFAOYSA-N |