2-{5-[(2-chlorophenoxy)methyl]furan-2-yl}-5-(methylamino)-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
2-{5-[(2-chlorophenoxy)methyl]furan-2-yl}-5-(methylamino)-1,3-oxazole-4-carbonitrile
2-{5-[(2-chlorophenoxy)methyl]furan-2-yl}-5-(methylamino)-1,3-oxazole-4-carbonitrile
Compound characteristics
Compound ID: | D561-0456 |
Compound Name: | 2-{5-[(2-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(COc3ccccc3[Cl])o2)o1 |
Stereo: | ACHIRAL |
logP: | 3.2434 |
logD: | 3.2434 |
logSw: | -3.6543 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 61.855 |
InChI Key: | YKXPYRWTFKXNFJ-UHFFFAOYSA-N |