2-[(4-bromophenoxy)methyl]-5-{[2-(4-methoxyphenyl)ethyl]amino}-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
2-[(4-bromophenoxy)methyl]-5-{[2-(4-methoxyphenyl)ethyl]amino}-1,3-oxazole-4-carbonitrile
2-[(4-bromophenoxy)methyl]-5-{[2-(4-methoxyphenyl)ethyl]amino}-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | 5677-0269 |
| Compound Name: | 2-[(4-bromophenoxy)methyl]-5-{[2-(4-methoxyphenyl)ethyl]amino}-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 428.28 |
| Molecular Formula: | C20 H18 Br N3 O3 |
| Smiles: | [H]N(CCc1ccc(cc1)OC)c1c(C#N)nc(COc2ccc(cc2)[Br])o1 |
| Stereo: | ACHIRAL |
| logP: | 4.2469 |
| logD: | 4.2469 |
| logSw: | -4.3308 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.828 |
| InChI Key: | RUKCAGUNSGKYII-UHFFFAOYSA-N |