1-(4-{[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,4-diazepan-1-yl)-2-(4-fluorophenyl)ethan-1-one
Chemical Structure Depiction of
1-(4-{[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,4-diazepan-1-yl)-2-(4-fluorophenyl)ethan-1-one
1-(4-{[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,4-diazepan-1-yl)-2-(4-fluorophenyl)ethan-1-one
Compound characteristics
| Compound ID: | M613-1509 |
| Compound Name: | 1-(4-{[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,4-diazepan-1-yl)-2-(4-fluorophenyl)ethan-1-one |
| Molecular Weight: | 428.89 |
| Molecular Formula: | C22 H22 Cl F N4 O2 |
| Smiles: | C1CN(CCN(C1)C(Cc1ccc(cc1)F)=O)Cc1nc(c2ccc(cc2)[Cl])no1 |
| Stereo: | ACHIRAL |
| logP: | 4.0706 |
| logD: | 4.0698 |
| logSw: | -4.4772 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.574 |
| InChI Key: | SGMVLRQGSZOFLR-UHFFFAOYSA-N |