5-(diethylamino)-2-{[(2-methoxyphenyl)-N-(2-methylpropyl)carbamamido]methyl}phenyl 3,4-dichlorobenzene-1-sulfonate
Chemical Structure Depiction of
5-(diethylamino)-2-{[(2-methoxyphenyl)-N-(2-methylpropyl)carbamamido]methyl}phenyl 3,4-dichlorobenzene-1-sulfonate
5-(diethylamino)-2-{[(2-methoxyphenyl)-N-(2-methylpropyl)carbamamido]methyl}phenyl 3,4-dichlorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V030-5369 |
| Compound Name: | 5-(diethylamino)-2-{[(2-methoxyphenyl)-N-(2-methylpropyl)carbamamido]methyl}phenyl 3,4-dichlorobenzene-1-sulfonate |
| Molecular Weight: | 608.58 |
| Molecular Formula: | C29 H35 Cl2 N3 O5 S |
| Salt: | not_available |
| Smiles: | CCN(CC)c1ccc(CN(CC(C)C)C(Nc2ccccc2OC)=O)c(c1)OS(c1ccc(c(c1)[Cl])[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 7.5362 |
| logD: | 7.5255 |
| logSw: | -6.4211 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.787 |
| InChI Key: | QHUCBFQYJIYYNL-UHFFFAOYSA-N |