3-{[(2-methoxyethyl)(thiophene-2-carbonyl)amino]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate
Chemical Structure Depiction of
3-{[(2-methoxyethyl)(thiophene-2-carbonyl)amino]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate
3-{[(2-methoxyethyl)(thiophene-2-carbonyl)amino]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate
Compound characteristics
| Compound ID: | V029-4045 |
| Compound Name: | 3-{[(2-methoxyethyl)(thiophene-2-carbonyl)amino]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate |
| Molecular Weight: | 480 |
| Molecular Formula: | C22 H22 Cl N O5 S2 |
| Smiles: | Cc1cccc(c1S(=O)(=O)Oc1cccc(CN(CCOC)C(c2cccs2)=O)c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.2947 |
| logD: | 4.2947 |
| logSw: | -4.4535 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.55 |
| InChI Key: | DGPLCJYXYUNWFQ-UHFFFAOYSA-N |