N-{2-[5-(1-ethyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)-1,2,4-oxadiazol-3-yl]ethyl}-N'-(2-fluorophenyl)-N-methylurea
Chemical Structure Depiction of
N-{2-[5-(1-ethyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)-1,2,4-oxadiazol-3-yl]ethyl}-N'-(2-fluorophenyl)-N-methylurea
N-{2-[5-(1-ethyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)-1,2,4-oxadiazol-3-yl]ethyl}-N'-(2-fluorophenyl)-N-methylurea
Compound characteristics
| Compound ID: | SC01-0030 |
| Compound Name: | N-{2-[5-(1-ethyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)-1,2,4-oxadiazol-3-yl]ethyl}-N'-(2-fluorophenyl)-N-methylurea |
| Molecular Weight: | 414.44 |
| Molecular Formula: | C20 H23 F N6 O3 |
| Smiles: | CCn1c2CCOCc2c(c2nc(CCN(C)C(Nc3ccccc3F)=O)no2)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.9605 |
| logD: | 1.9605 |
| logSw: | -2.3428 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.942 |
| InChI Key: | YXJANQYLACWAMH-UHFFFAOYSA-N |