2-({acetyl[(oxolan-2-yl)methyl]amino}methyl)-4-chlorophenyl 4-acetamidobenzene-1-sulfonate
Chemical Structure Depiction of
2-({acetyl[(oxolan-2-yl)methyl]amino}methyl)-4-chlorophenyl 4-acetamidobenzene-1-sulfonate
2-({acetyl[(oxolan-2-yl)methyl]amino}methyl)-4-chlorophenyl 4-acetamidobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V005-4663 |
| Compound Name: | 2-({acetyl[(oxolan-2-yl)methyl]amino}methyl)-4-chlorophenyl 4-acetamidobenzene-1-sulfonate |
| Molecular Weight: | 480.97 |
| Molecular Formula: | C22 H25 Cl N2 O6 S |
| Smiles: | CC(Nc1ccc(cc1)S(=O)(=O)Oc1ccc(cc1CN(CC1CCCO1)C(C)=O)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.435 |
| logD: | 2.4349 |
| logSw: | -3.3996 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.682 |
| InChI Key: | RIODPLFBRVOHDV-HXUWFJFHSA-N |