2-cyclobutyl-1-{[1-(2,3-dihydro-1,4-benzodioxine-6-sulfonyl)pyrrolidin-3-yl]methyl}-5-methyl-1H-imidazole
Chemical Structure Depiction of
2-cyclobutyl-1-{[1-(2,3-dihydro-1,4-benzodioxine-6-sulfonyl)pyrrolidin-3-yl]methyl}-5-methyl-1H-imidazole
2-cyclobutyl-1-{[1-(2,3-dihydro-1,4-benzodioxine-6-sulfonyl)pyrrolidin-3-yl]methyl}-5-methyl-1H-imidazole
Compound characteristics
| Compound ID: | S779-2350 |
| Compound Name: | 2-cyclobutyl-1-{[1-(2,3-dihydro-1,4-benzodioxine-6-sulfonyl)pyrrolidin-3-yl]methyl}-5-methyl-1H-imidazole |
| Molecular Weight: | 417.53 |
| Molecular Formula: | C21 H27 N3 O4 S |
| Smiles: | Cc1cnc(C2CCC2)n1CC1CCN(C1)S(c1ccc2c(c1)OCCO2)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2103 |
| logD: | 0.4143 |
| logSw: | -2.3611 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.508 |
| InChI Key: | XHOOPHJTKCSQLK-MRXNPFEDSA-N |