2-[1-(2,3-dihydro-1,4-benzodioxine-6-sulfonyl)pyrrolidin-3-yl]-1-(3-methoxypropyl)-5-methyl-1H-imidazole
Chemical Structure Depiction of
2-[1-(2,3-dihydro-1,4-benzodioxine-6-sulfonyl)pyrrolidin-3-yl]-1-(3-methoxypropyl)-5-methyl-1H-imidazole
2-[1-(2,3-dihydro-1,4-benzodioxine-6-sulfonyl)pyrrolidin-3-yl]-1-(3-methoxypropyl)-5-methyl-1H-imidazole
Compound characteristics
Compound ID: | T158-1081 |
Compound Name: | 2-[1-(2,3-dihydro-1,4-benzodioxine-6-sulfonyl)pyrrolidin-3-yl]-1-(3-methoxypropyl)-5-methyl-1H-imidazole |
Molecular Weight: | 421.51 |
Molecular Formula: | C20 H27 N3 O5 S |
Smiles: | Cc1cnc(C2CCN(C2)S(c2ccc3c(c2)OCCO3)(=O)=O)n1CCCOC |
Stereo: | RACEMIC MIXTURE |
logP: | 1.4516 |
logD: | 1.1343 |
logSw: | -2.1441 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 67.577 |
InChI Key: | YRBVJUQLYIBYHG-MRXNPFEDSA-N |