N~1~-[1-(methanesulfonyl)pyrrolidin-3-yl]-N~2~-methyl-N~2~-[(5-methylpyridin-2-yl)methyl]-N~1~-(oxan-4-yl)ethane-1,2-diamine
Chemical Structure Depiction of
N~1~-[1-(methanesulfonyl)pyrrolidin-3-yl]-N~2~-methyl-N~2~-[(5-methylpyridin-2-yl)methyl]-N~1~-(oxan-4-yl)ethane-1,2-diamine
N~1~-[1-(methanesulfonyl)pyrrolidin-3-yl]-N~2~-methyl-N~2~-[(5-methylpyridin-2-yl)methyl]-N~1~-(oxan-4-yl)ethane-1,2-diamine
Compound characteristics
| Compound ID: | SB04-0126 |
| Compound Name: | N~1~-[1-(methanesulfonyl)pyrrolidin-3-yl]-N~2~-methyl-N~2~-[(5-methylpyridin-2-yl)methyl]-N~1~-(oxan-4-yl)ethane-1,2-diamine |
| Molecular Weight: | 410.58 |
| Molecular Formula: | C20 H34 N4 O3 S |
| Smiles: | Cc1ccc(CN(C)CCN(C2CCOCC2)C2CCN(C2)S(C)(=O)=O)nc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2415 |
| logD: | 1.1866 |
| logSw: | -2.0804 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 55.256 |
| InChI Key: | KIPYSHCLHNGEQY-HXUWFJFHSA-N |