3-(2-{4-[(1-ethyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)methyl]piperazin-1-yl}-2-oxoethyl)-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
3-(2-{4-[(1-ethyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)methyl]piperazin-1-yl}-2-oxoethyl)-1,3-benzoxazol-2(3H)-one
3-(2-{4-[(1-ethyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)methyl]piperazin-1-yl}-2-oxoethyl)-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | SC19-0543 |
| Compound Name: | 3-(2-{4-[(1-ethyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)methyl]piperazin-1-yl}-2-oxoethyl)-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 425.49 |
| Molecular Formula: | C22 H27 N5 O4 |
| Smiles: | CCn1c2CCOCc2c(CN2CCN(CC2)C(CN2C(=O)Oc3ccccc23)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 0.2661 |
| logD: | -2.3542 |
| logSw: | -1.5135 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 66.279 |
| InChI Key: | JJEQOFWSBLIXCM-UHFFFAOYSA-N |