8-[4-(2,5-dimethylphenyl)piperazine-1-sulfonyl]-4H-[1]benzopyrano[3,4-d][1,2]oxazole
Chemical Structure Depiction of
8-[4-(2,5-dimethylphenyl)piperazine-1-sulfonyl]-4H-[1]benzopyrano[3,4-d][1,2]oxazole
8-[4-(2,5-dimethylphenyl)piperazine-1-sulfonyl]-4H-[1]benzopyrano[3,4-d][1,2]oxazole
Compound characteristics
| Compound ID: | M030-0083 |
| Compound Name: | 8-[4-(2,5-dimethylphenyl)piperazine-1-sulfonyl]-4H-[1]benzopyrano[3,4-d][1,2]oxazole |
| Molecular Weight: | 425.51 |
| Molecular Formula: | C22 H23 N3 O4 S |
| Smiles: | Cc1ccc(C)c(c1)N1CCN(CC1)S(c1ccc2c(c1)c1c(CO2)cno1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7989 |
| logD: | 3.7989 |
| logSw: | -3.8496 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.092 |
| InChI Key: | BUEZDHYMTGRJQS-UHFFFAOYSA-N |