3-{[(2-methoxyethyl)(thiophene-2-carbonyl)amino]methyl}phenyl propane-2-sulfonate
Chemical Structure Depiction of
3-{[(2-methoxyethyl)(thiophene-2-carbonyl)amino]methyl}phenyl propane-2-sulfonate
3-{[(2-methoxyethyl)(thiophene-2-carbonyl)amino]methyl}phenyl propane-2-sulfonate
Compound characteristics
| Compound ID: | V001-8029 |
| Compound Name: | 3-{[(2-methoxyethyl)(thiophene-2-carbonyl)amino]methyl}phenyl propane-2-sulfonate |
| Molecular Weight: | 397.51 |
| Molecular Formula: | C18 H23 N O5 S2 |
| Smiles: | CC(C)S(=O)(=O)Oc1cccc(CN(CCOC)C(c2cccs2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.844 |
| logD: | 2.844 |
| logSw: | -3.3956 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.822 |
| InChI Key: | SWNKXFSLBUOAMG-UHFFFAOYSA-N |