2-{[(butan-2-yl)(furan-2-carbonyl)amino]methyl}-5-(diethylamino)phenyl ethanesulfonate
Chemical Structure Depiction of
2-{[(butan-2-yl)(furan-2-carbonyl)amino]methyl}-5-(diethylamino)phenyl ethanesulfonate
2-{[(butan-2-yl)(furan-2-carbonyl)amino]methyl}-5-(diethylamino)phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V027-9945 |
| Compound Name: | 2-{[(butan-2-yl)(furan-2-carbonyl)amino]methyl}-5-(diethylamino)phenyl ethanesulfonate |
| Molecular Weight: | 436.57 |
| Molecular Formula: | C22 H32 N2 O5 S |
| Salt: | not_available |
| Smiles: | CCC(C)N(Cc1ccc(cc1OS(CC)(=O)=O)N(CC)CC)C(c1ccco1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1055 |
| logD: | 4.0959 |
| logSw: | -4.0396 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.288 |
| InChI Key: | SSUCCYCCVAPKHB-KRWDZBQOSA-N |