2-methoxy-5-({3-methyl-N-[(oxolan-2-yl)methyl]butanamido}methyl)phenyl 3,4-dichlorobenzene-1-sulfonate
Chemical Structure Depiction of
2-methoxy-5-({3-methyl-N-[(oxolan-2-yl)methyl]butanamido}methyl)phenyl 3,4-dichlorobenzene-1-sulfonate
2-methoxy-5-({3-methyl-N-[(oxolan-2-yl)methyl]butanamido}methyl)phenyl 3,4-dichlorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V025-5085 |
| Compound Name: | 2-methoxy-5-({3-methyl-N-[(oxolan-2-yl)methyl]butanamido}methyl)phenyl 3,4-dichlorobenzene-1-sulfonate |
| Molecular Weight: | 530.47 |
| Molecular Formula: | C24 H29 Cl2 N O6 S |
| Smiles: | CC(C)CC(N(CC1CCCO1)Cc1ccc(c(c1)OS(c1ccc(c(c1)[Cl])[Cl])(=O)=O)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5463 |
| logD: | 4.5463 |
| logSw: | -4.5934 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.055 |
| InChI Key: | UQMIOWYCVILICG-GOSISDBHSA-N |