2-{[N-(butan-2-yl)(2-methoxyphenyl)carbamamido]methyl}-5-(diethylamino)phenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
2-{[N-(butan-2-yl)(2-methoxyphenyl)carbamamido]methyl}-5-(diethylamino)phenyl 4-methoxybenzene-1-sulfonate
2-{[N-(butan-2-yl)(2-methoxyphenyl)carbamamido]methyl}-5-(diethylamino)phenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V022-3036 |
| Compound Name: | 2-{[N-(butan-2-yl)(2-methoxyphenyl)carbamamido]methyl}-5-(diethylamino)phenyl 4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 569.72 |
| Molecular Formula: | C30 H39 N3 O6 S |
| Salt: | not_available |
| Smiles: | CCC(C)N(Cc1ccc(cc1OS(c1ccc(cc1)OC)(=O)=O)N(CC)CC)C(Nc1ccccc1OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.4463 |
| logD: | 6.4356 |
| logSw: | -5.6272 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.659 |
| InChI Key: | SVSSABDLPBYYTF-QFIPXVFZSA-N |