N-(5-chloro-2,4-dimethoxyphenyl)-4H-[1]benzopyrano[3,4-d][1,2]oxazole-8-sulfonamide
Chemical Structure Depiction of
N-(5-chloro-2,4-dimethoxyphenyl)-4H-[1]benzopyrano[3,4-d][1,2]oxazole-8-sulfonamide
N-(5-chloro-2,4-dimethoxyphenyl)-4H-[1]benzopyrano[3,4-d][1,2]oxazole-8-sulfonamide
Compound characteristics
| Compound ID: | M030-0034 |
| Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-4H-[1]benzopyrano[3,4-d][1,2]oxazole-8-sulfonamide |
| Molecular Weight: | 422.84 |
| Molecular Formula: | C18 H15 Cl N2 O6 S |
| Smiles: | COc1cc(c(cc1NS(c1ccc2c(c1)c1c(CO2)cno1)(=O)=O)[Cl])OC |
| Stereo: | ACHIRAL |
| logP: | 2.939 |
| logD: | 1.386 |
| logSw: | -3.6211 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.634 |
| InChI Key: | GEJQBRULNFQKOZ-UHFFFAOYSA-N |