N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(5-bromothiophen-2-yl)-5-methyl-1,2-oxazole-4-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(5-bromothiophen-2-yl)-5-methyl-1,2-oxazole-4-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(5-bromothiophen-2-yl)-5-methyl-1,2-oxazole-4-carboxamide
Compound characteristics
| Compound ID: | F082-0868 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(5-bromothiophen-2-yl)-5-methyl-1,2-oxazole-4-carboxamide |
| Molecular Weight: | 421.27 |
| Molecular Formula: | C17 H13 Br N2 O4 S |
| Smiles: | Cc1c(C(NCc2ccc3c(c2)OCO3)=O)c(c2ccc(s2)[Br])no1 |
| Stereo: | ACHIRAL |
| logP: | 3.6717 |
| logD: | 3.6717 |
| logSw: | -4.1567 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.746 |
| InChI Key: | GJWLJWTXKWFUAP-UHFFFAOYSA-N |