4-chloro-2-{[ethyl-N-(2-methoxyethyl)carbamamido]methyl}phenyl 4-acetamidobenzene-1-sulfonate
Chemical Structure Depiction of
4-chloro-2-{[ethyl-N-(2-methoxyethyl)carbamamido]methyl}phenyl 4-acetamidobenzene-1-sulfonate
4-chloro-2-{[ethyl-N-(2-methoxyethyl)carbamamido]methyl}phenyl 4-acetamidobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V024-3727 |
| Compound Name: | 4-chloro-2-{[ethyl-N-(2-methoxyethyl)carbamamido]methyl}phenyl 4-acetamidobenzene-1-sulfonate |
| Molecular Weight: | 483.97 |
| Molecular Formula: | C21 H26 Cl N3 O6 S |
| Smiles: | CCNC(N(CCOC)Cc1cc(ccc1OS(c1ccc(cc1)NC(C)=O)(=O)=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.552 |
| logD: | 2.5519 |
| logSw: | -3.4096 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.921 |
| InChI Key: | FVWXCHMIYZQTQS-UHFFFAOYSA-N |