{4-[(dimethylamino)methyl]-5-methyl-1,2-oxazol-3-yl}{rel-(4R,5R)-4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-7-methyl-2,7-diazaspiro[4.4]nonan-2-yl}methanone
Chemical Structure Depiction of
{4-[(dimethylamino)methyl]-5-methyl-1,2-oxazol-3-yl}{rel-(4R,5R)-4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-7-methyl-2,7-diazaspiro[4.4]nonan-2-yl}methanone
{4-[(dimethylamino)methyl]-5-methyl-1,2-oxazol-3-yl}{rel-(4R,5R)-4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-7-methyl-2,7-diazaspiro[4.4]nonan-2-yl}methanone
Compound characteristics
| Compound ID: | SC85-0561 |
| Compound Name: | {4-[(dimethylamino)methyl]-5-methyl-1,2-oxazol-3-yl}{rel-(4R,5R)-4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-7-methyl-2,7-diazaspiro[4.4]nonan-2-yl}methanone |
| Molecular Weight: | 468.53 |
| Molecular Formula: | C24 H29 F N6 O3 |
| Smiles: | Cc1c(CN(C)C)c(C(N2C[C@@H](c3nc(c4ccc(cc4)F)no3)[C@]3(CCN(C)C3)C2)=O)no1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.4248 |
| logD: | -2.8599 |
| logSw: | -2.5391 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 78.341 |
| InChI Key: | ZAZZSMPAEFFVSC-CYFREDJKSA-N |