N~1~-[1-(methanesulfonyl)piperidin-3-yl]-N~2~-methyl-N~1~-(oxan-4-yl)-N~2~-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]ethane-1,2-diamine
Chemical Structure Depiction of
N~1~-[1-(methanesulfonyl)piperidin-3-yl]-N~2~-methyl-N~1~-(oxan-4-yl)-N~2~-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]ethane-1,2-diamine
N~1~-[1-(methanesulfonyl)piperidin-3-yl]-N~2~-methyl-N~1~-(oxan-4-yl)-N~2~-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]ethane-1,2-diamine
Compound characteristics
| Compound ID: | SB03-0186 |
| Compound Name: | N~1~-[1-(methanesulfonyl)piperidin-3-yl]-N~2~-methyl-N~1~-(oxan-4-yl)-N~2~-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]ethane-1,2-diamine |
| Molecular Weight: | 441.64 |
| Molecular Formula: | C21 H39 N5 O3 S |
| Smiles: | Cc1c(CN(C)CCN(C2CCOCC2)C2CCCN(C2)S(C)(=O)=O)c(C)n(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.2743 |
| logD: | -2.1912 |
| logSw: | -1.1263 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 60.097 |
| InChI Key: | MGQUEVWYPMPYKP-FQEVSTJZSA-N |