5-(butylamino)-2-{5-[(4-methylphenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
5-(butylamino)-2-{5-[(4-methylphenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile
5-(butylamino)-2-{5-[(4-methylphenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | D301-0055 |
| Compound Name: | 5-(butylamino)-2-{5-[(4-methylphenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 351.4 |
| Molecular Formula: | C20 H21 N3 O3 |
| Smiles: | CCCCNc1c(C#N)nc(c2ccc(COc3ccc(C)cc3)o2)o1 |
| Stereo: | ACHIRAL |
| logP: | 4.7651 |
| logD: | 4.7651 |
| logSw: | -4.4591 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.46 |
| InChI Key: | KKBKGZHMHGTTPB-UHFFFAOYSA-N |