3-{[(cyclopropylmethyl)(methoxyacetyl)amino]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate
Chemical Structure Depiction of
3-{[(cyclopropylmethyl)(methoxyacetyl)amino]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate
3-{[(cyclopropylmethyl)(methoxyacetyl)amino]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate
Compound characteristics
| Compound ID: | V028-1641 |
| Compound Name: | 3-{[(cyclopropylmethyl)(methoxyacetyl)amino]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate |
| Molecular Weight: | 437.94 |
| Molecular Formula: | C21 H24 Cl N O5 S |
| Smiles: | Cc1cccc(c1S(=O)(=O)Oc1cccc(CN(CC2CC2)C(COC)=O)c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.3604 |
| logD: | 3.3604 |
| logSw: | -3.4819 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.631 |
| InChI Key: | XYGRAXKDTQNWLN-UHFFFAOYSA-N |