1-(4-{[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,4-diazepan-1-yl)butan-1-one
Chemical Structure Depiction of
1-(4-{[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,4-diazepan-1-yl)butan-1-one
1-(4-{[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,4-diazepan-1-yl)butan-1-one
Compound characteristics
| Compound ID: | M613-1526 |
| Compound Name: | 1-(4-{[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,4-diazepan-1-yl)butan-1-one |
| Molecular Weight: | 362.86 |
| Molecular Formula: | C18 H23 Cl N4 O2 |
| Smiles: | CCCC(N1CCCN(CC1)Cc1nc(c2ccc(cc2)[Cl])no1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4739 |
| logD: | 3.4732 |
| logSw: | -3.9197 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.845 |
| InChI Key: | JQTDLYXIRWOJHM-UHFFFAOYSA-N |