{4-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-1,4-diazepan-1-yl}(quinolin-6-yl)methanone
Chemical Structure Depiction of
{4-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-1,4-diazepan-1-yl}(quinolin-6-yl)methanone
{4-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-1,4-diazepan-1-yl}(quinolin-6-yl)methanone
Compound characteristics
| Compound ID: | P803-1105 |
| Compound Name: | {4-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-1,4-diazepan-1-yl}(quinolin-6-yl)methanone |
| Molecular Weight: | 431.92 |
| Molecular Formula: | C24 H22 Cl N5 O |
| Smiles: | C1CN(CCN(C1)c1cc(c2ccc(cc2)[Cl])n[nH]1)C(c1ccc2c(cccn2)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2086 |
| logD: | 4.2086 |
| logSw: | -4.3536 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.194 |
| InChI Key: | JUGFNKIDASVLME-UHFFFAOYSA-N |