N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylbenzene-1-sulfonyl]propanamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylbenzene-1-sulfonyl]propanamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylbenzene-1-sulfonyl]propanamide
Compound characteristics
| Compound ID: | F382-1628 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylbenzene-1-sulfonyl]propanamide |
| Molecular Weight: | 456.52 |
| Molecular Formula: | C23 H24 N2 O6 S |
| Smiles: | Cc1ccc(cc1S(CCC(NCc1ccc2c(c1)OCO2)=O)(=O)=O)c1c(C)c(C)no1 |
| Stereo: | ACHIRAL |
| logP: | 3.5236 |
| logD: | 3.5236 |
| logSw: | -3.8301 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.935 |
| InChI Key: | ZXXNTZWPGRNWNV-UHFFFAOYSA-N |