5-(diethylamino)-2-({ethyl-N-[(oxolan-2-yl)methyl]carbamamido}methyl)phenyl ethanesulfonate
Chemical Structure Depiction of
5-(diethylamino)-2-({ethyl-N-[(oxolan-2-yl)methyl]carbamamido}methyl)phenyl ethanesulfonate
5-(diethylamino)-2-({ethyl-N-[(oxolan-2-yl)methyl]carbamamido}methyl)phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V026-4720 |
| Compound Name: | 5-(diethylamino)-2-({ethyl-N-[(oxolan-2-yl)methyl]carbamamido}methyl)phenyl ethanesulfonate |
| Molecular Weight: | 441.59 |
| Molecular Formula: | C21 H35 N3 O5 S |
| Salt: | not_available |
| Smiles: | CCNC(N(CC1CCCO1)Cc1ccc(cc1OS(CC)(=O)=O)N(CC)CC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5166 |
| logD: | 2.507 |
| logSw: | -2.9863 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.804 |
| InChI Key: | ZYTAZUZSIAYJRD-LJQANCHMSA-N |