4-iodo-2-methyl-6-({[2-(3-methylphenyl)-1,3-benzoxazol-5-yl]amino}methyl)phenol
Chemical Structure Depiction of
4-iodo-2-methyl-6-({[2-(3-methylphenyl)-1,3-benzoxazol-5-yl]amino}methyl)phenol
4-iodo-2-methyl-6-({[2-(3-methylphenyl)-1,3-benzoxazol-5-yl]amino}methyl)phenol
Compound characteristics
| Compound ID: | K630-0088 |
| Compound Name: | 4-iodo-2-methyl-6-({[2-(3-methylphenyl)-1,3-benzoxazol-5-yl]amino}methyl)phenol |
| Molecular Weight: | 470.31 |
| Molecular Formula: | C22 H19 I N2 O2 |
| Smiles: | Cc1cccc(c1)c1nc2cc(ccc2o1)NCc1cc(cc(C)c1O)I |
| Stereo: | ACHIRAL |
| logP: | 6.2251 |
| logD: | 6.225 |
| logSw: | -5.467 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 42.762 |
| InChI Key: | HHYQHIKQWBOFFM-UHFFFAOYSA-N |