1-[3-(3-propyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-4-{[3-(trifluoromethyl)phenyl]methyl}-1,4-diazepane
Chemical Structure Depiction of
1-[3-(3-propyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-4-{[3-(trifluoromethyl)phenyl]methyl}-1,4-diazepane
1-[3-(3-propyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-4-{[3-(trifluoromethyl)phenyl]methyl}-1,4-diazepane
Compound characteristics
| Compound ID: | P891-0264 |
| Compound Name: | 1-[3-(3-propyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-4-{[3-(trifluoromethyl)phenyl]methyl}-1,4-diazepane |
| Molecular Weight: | 445.49 |
| Molecular Formula: | C23 H26 F3 N5 O |
| Smiles: | CCCc1nc(c2cccnc2N2CCCN(CC2)Cc2cccc(c2)C(F)(F)F)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.9312 |
| logD: | 4.7366 |
| logSw: | -4.6153 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.211 |
| InChI Key: | IFVXCBQHKDOSAW-UHFFFAOYSA-N |