N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-{5-methyl-4-[(phenylsulfanyl)methyl]-1,3-oxazol-2-yl}benzamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-{5-methyl-4-[(phenylsulfanyl)methyl]-1,3-oxazol-2-yl}benzamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-{5-methyl-4-[(phenylsulfanyl)methyl]-1,3-oxazol-2-yl}benzamide
Compound characteristics
| Compound ID: | E776-0299 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-{5-methyl-4-[(phenylsulfanyl)methyl]-1,3-oxazol-2-yl}benzamide |
| Molecular Weight: | 458.54 |
| Molecular Formula: | C26 H22 N2 O4 S |
| Smiles: | Cc1c(CSc2ccccc2)nc(c2ccc(cc2)C(NCc2ccc3c(c2)OCO3)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 4.9662 |
| logD: | 4.9662 |
| logSw: | -4.6807 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.618 |
| InChI Key: | GTENQBGQQAYEOY-UHFFFAOYSA-N |