2-{[(butan-2-yl)(furan-2-carbonyl)amino]methyl}-5-(diethylamino)phenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
2-{[(butan-2-yl)(furan-2-carbonyl)amino]methyl}-5-(diethylamino)phenyl 4-methoxybenzene-1-sulfonate
2-{[(butan-2-yl)(furan-2-carbonyl)amino]methyl}-5-(diethylamino)phenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V024-4199 |
| Compound Name: | 2-{[(butan-2-yl)(furan-2-carbonyl)amino]methyl}-5-(diethylamino)phenyl 4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 514.64 |
| Molecular Formula: | C27 H34 N2 O6 S |
| Salt: | not_available |
| Smiles: | CCC(C)N(Cc1ccc(cc1OS(c1ccc(cc1)OC)(=O)=O)N(CC)CC)C(c1ccco1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.345 |
| logD: | 5.3343 |
| logSw: | -5.3911 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.484 |
| InChI Key: | ZYCLVKLBCRNMIB-FQEVSTJZSA-N |