8-[4-(3-methoxyphenyl)piperazine-1-sulfonyl]-4H-[1]benzopyrano[3,4-d][1,2]oxazole
Chemical Structure Depiction of
8-[4-(3-methoxyphenyl)piperazine-1-sulfonyl]-4H-[1]benzopyrano[3,4-d][1,2]oxazole
8-[4-(3-methoxyphenyl)piperazine-1-sulfonyl]-4H-[1]benzopyrano[3,4-d][1,2]oxazole
Compound characteristics
| Compound ID: | M030-0066 |
| Compound Name: | 8-[4-(3-methoxyphenyl)piperazine-1-sulfonyl]-4H-[1]benzopyrano[3,4-d][1,2]oxazole |
| Molecular Weight: | 427.48 |
| Molecular Formula: | C21 H21 N3 O5 S |
| Smiles: | COc1cccc(c1)N1CCN(CC1)S(c1ccc2c(c1)c1c(CO2)cno1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.749 |
| logD: | 2.749 |
| logSw: | -3.1606 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 72.937 |
| InChI Key: | MRLKXMXTPPVILV-UHFFFAOYSA-N |