2-{5-[(4-chlorophenoxy)methyl]furan-2-yl}-5-(methylamino)-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
2-{5-[(4-chlorophenoxy)methyl]furan-2-yl}-5-(methylamino)-1,3-oxazole-4-carbonitrile
2-{5-[(4-chlorophenoxy)methyl]furan-2-yl}-5-(methylamino)-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | D301-0104 |
| Compound Name: | 2-{5-[(4-chlorophenoxy)methyl]furan-2-yl}-5-(methylamino)-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 329.74 |
| Molecular Formula: | C16 H12 Cl N3 O3 |
| Smiles: | CNc1c(C#N)nc(c2ccc(COc3ccc(cc3)[Cl])o2)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.4435 |
| logD: | 3.4435 |
| logSw: | -3.8398 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.769 |
| InChI Key: | MRKVTFXALALKJK-UHFFFAOYSA-N |