5-(diethylamino)-2-({[2-(dimethylamino)ethyl](phenoxyacetyl)amino}methyl)phenyl ethanesulfonate
Chemical Structure Depiction of
5-(diethylamino)-2-({[2-(dimethylamino)ethyl](phenoxyacetyl)amino}methyl)phenyl ethanesulfonate
5-(diethylamino)-2-({[2-(dimethylamino)ethyl](phenoxyacetyl)amino}methyl)phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V028-6650 |
| Compound Name: | 5-(diethylamino)-2-({[2-(dimethylamino)ethyl](phenoxyacetyl)amino}methyl)phenyl ethanesulfonate |
| Molecular Weight: | 491.65 |
| Molecular Formula: | C25 H37 N3 O5 S |
| Salt: | not_available |
| Smiles: | CCN(CC)c1ccc(CN(CCN(C)C)C(COc2ccccc2)=O)c(c1)OS(CC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1423 |
| logD: | 2.2233 |
| logSw: | -3.3724 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.197 |
| InChI Key: | CKPWDRJSCGTVCS-UHFFFAOYSA-N |