5-methyl-3-{[2-(3-methylbutoxy)phenyl]methyl}-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
5-methyl-3-{[2-(3-methylbutoxy)phenyl]methyl}-1,3-benzoxazol-2(3H)-one
5-methyl-3-{[2-(3-methylbutoxy)phenyl]methyl}-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | 6494-0077 |
| Compound Name: | 5-methyl-3-{[2-(3-methylbutoxy)phenyl]methyl}-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 325.41 |
| Molecular Formula: | C20 H23 N O3 |
| Smiles: | CC(C)CCOc1ccccc1CN1C(=O)Oc2ccc(C)cc12 |
| Stereo: | ACHIRAL |
| logP: | 5.4174 |
| logD: | 5.4174 |
| logSw: | -5.3339 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 30.5713 |
| InChI Key: | VEAWIRNHRVCCQY-UHFFFAOYSA-N |