5-(diethylamino)-2-({N-[(oxolan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenyl ethanesulfonate
Chemical Structure Depiction of
5-(diethylamino)-2-({N-[(oxolan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenyl ethanesulfonate
5-(diethylamino)-2-({N-[(oxolan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V026-1767 |
| Compound Name: | 5-(diethylamino)-2-({N-[(oxolan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenyl ethanesulfonate |
| Molecular Weight: | 455.62 |
| Molecular Formula: | C22 H37 N3 O5 S |
| Salt: | not_available |
| Smiles: | CCN(CC)c1ccc(CN(CC2CCCO2)C(NC(C)C)=O)c(c1)OS(CC)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1085 |
| logD: | 3.0989 |
| logSw: | -3.544 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.152 |
| InChI Key: | DGJKQYITESLUPF-HXUWFJFHSA-N |