methyl 4-{[N-(3-chloro-4-methoxybenzene-1-sulfonyl)-N-methylglycyl]amino}benzoate
Chemical Structure Depiction of
methyl 4-{[N-(3-chloro-4-methoxybenzene-1-sulfonyl)-N-methylglycyl]amino}benzoate
methyl 4-{[N-(3-chloro-4-methoxybenzene-1-sulfonyl)-N-methylglycyl]amino}benzoate
Compound characteristics
| Compound ID: | Y050-0019 |
| Compound Name: | methyl 4-{[N-(3-chloro-4-methoxybenzene-1-sulfonyl)-N-methylglycyl]amino}benzoate |
| Molecular Weight: | 426.87 |
| Molecular Formula: | C18 H19 Cl N2 O6 S |
| Smiles: | CN(CC(Nc1ccc(cc1)C(=O)OC)=O)S(c1ccc(c(c1)[Cl])OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0013 |
| logD: | 3.0005 |
| logSw: | -3.6403 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.756 |
| InChI Key: | JWTJNSCXILFVOG-UHFFFAOYSA-N |