N~1~-[1-(methanesulfonyl)piperidin-3-yl]-N~2~-methyl-N~2~-[(1-methyl-1H-pyrrol-2-yl)methyl]-N~1~-(oxan-4-yl)ethane-1,2-diamine
Chemical Structure Depiction of
N~1~-[1-(methanesulfonyl)piperidin-3-yl]-N~2~-methyl-N~2~-[(1-methyl-1H-pyrrol-2-yl)methyl]-N~1~-(oxan-4-yl)ethane-1,2-diamine
N~1~-[1-(methanesulfonyl)piperidin-3-yl]-N~2~-methyl-N~2~-[(1-methyl-1H-pyrrol-2-yl)methyl]-N~1~-(oxan-4-yl)ethane-1,2-diamine
Compound characteristics
| Compound ID: | SB03-0115 |
| Compound Name: | N~1~-[1-(methanesulfonyl)piperidin-3-yl]-N~2~-methyl-N~2~-[(1-methyl-1H-pyrrol-2-yl)methyl]-N~1~-(oxan-4-yl)ethane-1,2-diamine |
| Molecular Weight: | 412.59 |
| Molecular Formula: | C20 H36 N4 O3 S |
| Smiles: | CN(CCN(C1CCOCC1)C1CCCN(C1)S(C)(=O)=O)Cc1cccn1C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1599 |
| logD: | 1.0674 |
| logSw: | -2.1729 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 48.155 |
| InChI Key: | VVEZCZLPQSPSQJ-FQEVSTJZSA-N |