methyl 2-[2-chloro-5-(thiomorpholine-4-sulfonyl)benzamido]benzoate
Chemical Structure Depiction of
methyl 2-[2-chloro-5-(thiomorpholine-4-sulfonyl)benzamido]benzoate
methyl 2-[2-chloro-5-(thiomorpholine-4-sulfonyl)benzamido]benzoate
Compound characteristics
| Compound ID: | L586-1353 |
| Compound Name: | methyl 2-[2-chloro-5-(thiomorpholine-4-sulfonyl)benzamido]benzoate |
| Molecular Weight: | 454.95 |
| Molecular Formula: | C19 H19 Cl N2 O5 S2 |
| Smiles: | COC(c1ccccc1NC(c1cc(ccc1[Cl])S(N1CCSCC1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4134 |
| logD: | 1.7107 |
| logSw: | -3.8786 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.517 |
| InChI Key: | BUUJYRIHSAHOJY-UHFFFAOYSA-N |