(2-chloro-4-fluorophenyl)(4-{[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,4-diazepan-1-yl)methanone
Chemical Structure Depiction of
(2-chloro-4-fluorophenyl)(4-{[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,4-diazepan-1-yl)methanone
(2-chloro-4-fluorophenyl)(4-{[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,4-diazepan-1-yl)methanone
Compound characteristics
| Compound ID: | M613-1042 |
| Compound Name: | (2-chloro-4-fluorophenyl)(4-{[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,4-diazepan-1-yl)methanone |
| Molecular Weight: | 428.89 |
| Molecular Formula: | C22 H22 Cl F N4 O2 |
| Smiles: | Cc1ccc(cc1)c1nc(CN2CCCN(CC2)C(c2ccc(cc2[Cl])F)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.2166 |
| logD: | 4.2165 |
| logSw: | -4.5362 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.101 |
| InChI Key: | ZHJWAIXJXLPAAM-UHFFFAOYSA-N |