(3-chloro-4-fluorophenyl)(4-{3-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]pyridin-2-yl}-1,4-diazepan-1-yl)methanone
Chemical Structure Depiction of
(3-chloro-4-fluorophenyl)(4-{3-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]pyridin-2-yl}-1,4-diazepan-1-yl)methanone
(3-chloro-4-fluorophenyl)(4-{3-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]pyridin-2-yl}-1,4-diazepan-1-yl)methanone
Compound characteristics
| Compound ID: | P891-1647 |
| Compound Name: | (3-chloro-4-fluorophenyl)(4-{3-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]pyridin-2-yl}-1,4-diazepan-1-yl)methanone |
| Molecular Weight: | 443.91 |
| Molecular Formula: | C22 H23 Cl F N5 O2 |
| Smiles: | CC(C)c1nc(c2cccnc2N2CCCN(CC2)C(c2ccc(c(c2)[Cl])F)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.1029 |
| logD: | 3.8771 |
| logSw: | -4.4429 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 61.136 |
| InChI Key: | MPTPXOXLRQWNTD-UHFFFAOYSA-N |