N-[(2,5-dimethoxyphenyl)methyl]-4H-[1]benzopyrano[3,4-d][1,2]oxazole-8-sulfonamide
Chemical Structure Depiction of
N-[(2,5-dimethoxyphenyl)methyl]-4H-[1]benzopyrano[3,4-d][1,2]oxazole-8-sulfonamide
N-[(2,5-dimethoxyphenyl)methyl]-4H-[1]benzopyrano[3,4-d][1,2]oxazole-8-sulfonamide
Compound characteristics
| Compound ID: | M030-0263 |
| Compound Name: | N-[(2,5-dimethoxyphenyl)methyl]-4H-[1]benzopyrano[3,4-d][1,2]oxazole-8-sulfonamide |
| Molecular Weight: | 402.42 |
| Molecular Formula: | C19 H18 N2 O6 S |
| Smiles: | COc1ccc(c(CNS(c2ccc3c(c2)c2c(CO3)cno2)(=O)=O)c1)OC |
| Stereo: | ACHIRAL |
| logP: | 2.5766 |
| logD: | 2.5763 |
| logSw: | -3.0234 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.354 |
| InChI Key: | SHJUFBASZQGCND-UHFFFAOYSA-N |