8-[4-(5-chloro-2-methylphenyl)piperazine-1-sulfonyl]-4H-[1]benzopyrano[3,4-d][1,2]oxazole
Chemical Structure Depiction of
8-[4-(5-chloro-2-methylphenyl)piperazine-1-sulfonyl]-4H-[1]benzopyrano[3,4-d][1,2]oxazole
8-[4-(5-chloro-2-methylphenyl)piperazine-1-sulfonyl]-4H-[1]benzopyrano[3,4-d][1,2]oxazole
Compound characteristics
| Compound ID: | M030-0084 |
| Compound Name: | 8-[4-(5-chloro-2-methylphenyl)piperazine-1-sulfonyl]-4H-[1]benzopyrano[3,4-d][1,2]oxazole |
| Molecular Weight: | 445.92 |
| Molecular Formula: | C21 H20 Cl N3 O4 S |
| Smiles: | Cc1ccc(cc1N1CCN(CC1)S(c1ccc2c(c1)c1c(CO2)cno1)(=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.9236 |
| logD: | 3.9236 |
| logSw: | -4.3396 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.092 |
| InChI Key: | HGUAONQKDGEOON-UHFFFAOYSA-N |