2-[(3-chlorophenoxy)methyl]-5-[(prop-2-en-1-yl)amino]-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
2-[(3-chlorophenoxy)methyl]-5-[(prop-2-en-1-yl)amino]-1,3-oxazole-4-carbonitrile
2-[(3-chlorophenoxy)methyl]-5-[(prop-2-en-1-yl)amino]-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | 6487-0100 |
| Compound Name: | 2-[(3-chlorophenoxy)methyl]-5-[(prop-2-en-1-yl)amino]-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 289.72 |
| Molecular Formula: | C14 H12 Cl N3 O2 |
| Smiles: | C=CCNc1c(C#N)nc(COc2cccc(c2)[Cl])o1 |
| Stereo: | ACHIRAL |
| logP: | 3.1618 |
| logD: | 3.1618 |
| logSw: | -3.5545 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.555 |
| InChI Key: | DHLPMUPHNHRZTK-UHFFFAOYSA-N |