5-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(3-methoxyphenyl)-4,5-dihydro-1,2-oxazole
Chemical Structure Depiction of
5-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(3-methoxyphenyl)-4,5-dihydro-1,2-oxazole
5-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(3-methoxyphenyl)-4,5-dihydro-1,2-oxazole
Compound characteristics
| Compound ID: | 8020-8642 |
| Compound Name: | 5-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(3-methoxyphenyl)-4,5-dihydro-1,2-oxazole |
| Molecular Weight: | 311.34 |
| Molecular Formula: | C18 H17 N O4 |
| Smiles: | COc1cccc(c1)C1CC(Cc2ccc3c(c2)OCO3)ON=1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1186 |
| logD: | 4.1186 |
| logSw: | -4.3977 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.462 |
| InChI Key: | CEKRNDWFZJIKQV-HNNXBMFYSA-N |