2-{[5-(5-chloro-1,3-benzoxazol-2-yl)-2-methylanilino]methyl}phenol
Chemical Structure Depiction of
2-{[5-(5-chloro-1,3-benzoxazol-2-yl)-2-methylanilino]methyl}phenol
2-{[5-(5-chloro-1,3-benzoxazol-2-yl)-2-methylanilino]methyl}phenol
Compound characteristics
| Compound ID: | K630-0095 |
| Compound Name: | 2-{[5-(5-chloro-1,3-benzoxazol-2-yl)-2-methylanilino]methyl}phenol |
| Molecular Weight: | 364.83 |
| Molecular Formula: | C21 H17 Cl N2 O2 |
| Smiles: | Cc1ccc(cc1NCc1ccccc1O)c1nc2cc(ccc2o1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.4806 |
| logD: | 5.4803 |
| logSw: | -5.7822 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 43.133 |
| InChI Key: | JOKOUNIRMGBAEO-UHFFFAOYSA-N |