(4-{[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,4-diazepan-1-yl)(2-methylphenyl)methanone
Chemical Structure Depiction of
(4-{[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,4-diazepan-1-yl)(2-methylphenyl)methanone
(4-{[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,4-diazepan-1-yl)(2-methylphenyl)methanone
Compound characteristics
| Compound ID: | M613-1541 |
| Compound Name: | (4-{[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,4-diazepan-1-yl)(2-methylphenyl)methanone |
| Molecular Weight: | 410.9 |
| Molecular Formula: | C22 H23 Cl N4 O2 |
| Smiles: | Cc1ccccc1C(N1CCCN(CC1)Cc1nc(c2ccc(cc2)[Cl])no1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1528 |
| logD: | 4.1527 |
| logSw: | -4.5409 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.101 |
| InChI Key: | SQYBLGSVBPPJBL-UHFFFAOYSA-N |