2-{5-[(2-chlorophenoxy)methyl]furan-2-yl}-5-(4-ethylpiperazin-1-yl)-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
2-{5-[(2-chlorophenoxy)methyl]furan-2-yl}-5-(4-ethylpiperazin-1-yl)-1,3-oxazole-4-carbonitrile
2-{5-[(2-chlorophenoxy)methyl]furan-2-yl}-5-(4-ethylpiperazin-1-yl)-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | D561-1032 |
| Compound Name: | 2-{5-[(2-chlorophenoxy)methyl]furan-2-yl}-5-(4-ethylpiperazin-1-yl)-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 412.87 |
| Molecular Formula: | C21 H21 Cl N4 O3 |
| Smiles: | CCN1CCN(CC1)c1c(C#N)nc(c2ccc(COc3ccccc3[Cl])o2)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.8471 |
| logD: | 3.3701 |
| logSw: | -4.134 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 58.447 |
| InChI Key: | JSSRWIBCNFWJLD-UHFFFAOYSA-N |