2-{5-[(4-bromophenoxy)methyl]furan-2-yl}-5-(4-methylpiperazin-1-yl)-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
2-{5-[(4-bromophenoxy)methyl]furan-2-yl}-5-(4-methylpiperazin-1-yl)-1,3-oxazole-4-carbonitrile
2-{5-[(4-bromophenoxy)methyl]furan-2-yl}-5-(4-methylpiperazin-1-yl)-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | D561-1015 |
| Compound Name: | 2-{5-[(4-bromophenoxy)methyl]furan-2-yl}-5-(4-methylpiperazin-1-yl)-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 443.3 |
| Molecular Formula: | C20 H19 Br N4 O3 |
| Smiles: | CN1CCN(CC1)c1c(C#N)nc(c2ccc(COc3ccc(cc3)[Br])o2)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.9416 |
| logD: | 3.5608 |
| logSw: | -3.9228 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 58.3 |
| InChI Key: | UMLNFFSUTZRITF-UHFFFAOYSA-N |