N-(6-acetyl-2H-1,3-benzodioxol-5-yl)-2-[(1,3-benzoxazol-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(6-acetyl-2H-1,3-benzodioxol-5-yl)-2-[(1,3-benzoxazol-2-yl)sulfanyl]acetamide
N-(6-acetyl-2H-1,3-benzodioxol-5-yl)-2-[(1,3-benzoxazol-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | Y510-5020 |
| Compound Name: | N-(6-acetyl-2H-1,3-benzodioxol-5-yl)-2-[(1,3-benzoxazol-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 370.38 |
| Molecular Formula: | C18 H14 N2 O5 S |
| Smiles: | CC(c1cc2c(cc1NC(CSc1nc3ccccc3o1)=O)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.091 |
| logD: | 3.0457 |
| logSw: | -3.3493 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.024 |
| InChI Key: | QQMGDNHWGABDQQ-UHFFFAOYSA-N |