N~1~-[(2,3-dihydro-1-benzofuran-5-yl)methyl]-N~2~-[1-(methanesulfonyl)pyrrolidin-3-yl]-N~1~-methyl-N~2~-(oxan-4-yl)ethane-1,2-diamine
Chemical Structure Depiction of
N~1~-[(2,3-dihydro-1-benzofuran-5-yl)methyl]-N~2~-[1-(methanesulfonyl)pyrrolidin-3-yl]-N~1~-methyl-N~2~-(oxan-4-yl)ethane-1,2-diamine
N~1~-[(2,3-dihydro-1-benzofuran-5-yl)methyl]-N~2~-[1-(methanesulfonyl)pyrrolidin-3-yl]-N~1~-methyl-N~2~-(oxan-4-yl)ethane-1,2-diamine
Compound characteristics
| Compound ID: | SB04-0121 |
| Compound Name: | N~1~-[(2,3-dihydro-1-benzofuran-5-yl)methyl]-N~2~-[1-(methanesulfonyl)pyrrolidin-3-yl]-N~1~-methyl-N~2~-(oxan-4-yl)ethane-1,2-diamine |
| Molecular Weight: | 437.6 |
| Molecular Formula: | C22 H35 N3 O4 S |
| Smiles: | CN(CCN(C1CCOCC1)C1CCN(C1)S(C)(=O)=O)Cc1ccc2c(CCO2)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.67 |
| logD: | 1.4814 |
| logSw: | -2.4759 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 53.861 |
| InChI Key: | DREJZWWPMBAJFV-OAQYLSRUSA-N |