4-{[(5-bromopyridin-2-yl)amino]methylidene}-2-(5-chloro-2-methoxyphenyl)-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-{[(5-bromopyridin-2-yl)amino]methylidene}-2-(5-chloro-2-methoxyphenyl)-1,3-oxazol-5(4H)-one
4-{[(5-bromopyridin-2-yl)amino]methylidene}-2-(5-chloro-2-methoxyphenyl)-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 2165-0678 |
| Compound Name: | 4-{[(5-bromopyridin-2-yl)amino]methylidene}-2-(5-chloro-2-methoxyphenyl)-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 408.64 |
| Molecular Formula: | C16 H11 Br Cl N3 O3 |
| Smiles: | COc1ccc(cc1C1=NC(=C/Nc2ccc(cn2)[Br])\C(=O)O1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.7892 |
| logD: | 3.6955 |
| logSw: | -4.2696 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.312 |
| InChI Key: | NGAKUVVLDJXRIU-UHFFFAOYSA-N |