3-{2-[3-(4-ethyl-4H-1,2,4-triazol-3-yl)-1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]-2-oxoethyl}-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
3-{2-[3-(4-ethyl-4H-1,2,4-triazol-3-yl)-1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]-2-oxoethyl}-1,3-benzoxazol-2(3H)-one
3-{2-[3-(4-ethyl-4H-1,2,4-triazol-3-yl)-1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]-2-oxoethyl}-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | S565-0584 |
| Compound Name: | 3-{2-[3-(4-ethyl-4H-1,2,4-triazol-3-yl)-1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]-2-oxoethyl}-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 407.43 |
| Molecular Formula: | C20 H21 N7 O3 |
| Smiles: | CCn1cnnc1c1c2CN(CCc2n(C)n1)C(CN1C(=O)Oc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 0.0579 |
| logD: | 0.0413 |
| logSw: | -1.5514 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 78.22 |
| InChI Key: | KFRPZHOSDLCUHA-UHFFFAOYSA-N |