(2-chloro-5-fluorophenyl)(4-{[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,4-diazepan-1-yl)methanone
Chemical Structure Depiction of
(2-chloro-5-fluorophenyl)(4-{[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,4-diazepan-1-yl)methanone
(2-chloro-5-fluorophenyl)(4-{[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,4-diazepan-1-yl)methanone
Compound characteristics
| Compound ID: | M613-1491 |
| Compound Name: | (2-chloro-5-fluorophenyl)(4-{[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,4-diazepan-1-yl)methanone |
| Molecular Weight: | 449.31 |
| Molecular Formula: | C21 H19 Cl2 F N4 O2 |
| Smiles: | C1CN(CCN(C1)C(c1cc(ccc1[Cl])F)=O)Cc1nc(c2ccc(cc2)[Cl])no1 |
| Stereo: | ACHIRAL |
| logP: | 4.6629 |
| logD: | 4.6628 |
| logSw: | -4.9272 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.101 |
| InChI Key: | VSWBPFNEPZDUFC-UHFFFAOYSA-N |