3-{2-[3-methyl-8-(pyrrolidine-1-carbonyl)-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl]-2-oxoethyl}-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
3-{2-[3-methyl-8-(pyrrolidine-1-carbonyl)-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl]-2-oxoethyl}-1,3-benzoxazol-2(3H)-one
3-{2-[3-methyl-8-(pyrrolidine-1-carbonyl)-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl]-2-oxoethyl}-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | SA05-0885 |
| Compound Name: | 3-{2-[3-methyl-8-(pyrrolidine-1-carbonyl)-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl]-2-oxoethyl}-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 410.43 |
| Molecular Formula: | C20 H22 N6 O4 |
| Smiles: | Cc1nnc2C(C(N3CCCC3)=O)N(CCn12)C(CN1C(=O)Oc2ccccc12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.1504 |
| logD: | 0.1504 |
| logSw: | -1.533 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 80.558 |
| InChI Key: | QDBAGKNQAKZEFL-QGZVFWFLSA-N |