4-benzyl-2-[({2-[(4-chlorophenyl)methyl]-1,3-benzoxazol-5-yl}amino)methyl]phenol
Chemical Structure Depiction of
4-benzyl-2-[({2-[(4-chlorophenyl)methyl]-1,3-benzoxazol-5-yl}amino)methyl]phenol
4-benzyl-2-[({2-[(4-chlorophenyl)methyl]-1,3-benzoxazol-5-yl}amino)methyl]phenol
Compound characteristics
| Compound ID: | K630-0107 |
| Compound Name: | 4-benzyl-2-[({2-[(4-chlorophenyl)methyl]-1,3-benzoxazol-5-yl}amino)methyl]phenol |
| Molecular Weight: | 454.96 |
| Molecular Formula: | C28 H23 Cl N2 O2 |
| Smiles: | C(c1ccccc1)c1ccc(c(CNc2ccc3c(c2)nc(Cc2ccc(cc2)[Cl])o3)c1)O |
| Stereo: | ACHIRAL |
| logP: | 7.072 |
| logD: | 7.0718 |
| logSw: | -6.2725 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 43.225 |
| InChI Key: | PUHYSMBDTSWFIW-UHFFFAOYSA-N |