methyl 4-{[1-(4-chlorobenzene-1-sulfonyl)-1,2,3,4-tetrahydroquinoline-6-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 4-{[1-(4-chlorobenzene-1-sulfonyl)-1,2,3,4-tetrahydroquinoline-6-carbonyl]amino}benzoate
methyl 4-{[1-(4-chlorobenzene-1-sulfonyl)-1,2,3,4-tetrahydroquinoline-6-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | D256-1204 |
| Compound Name: | methyl 4-{[1-(4-chlorobenzene-1-sulfonyl)-1,2,3,4-tetrahydroquinoline-6-carbonyl]amino}benzoate |
| Molecular Weight: | 484.96 |
| Molecular Formula: | C24 H21 Cl N2 O5 S |
| Smiles: | COC(c1ccc(cc1)NC(c1ccc2c(CCCN2S(c2ccc(cc2)[Cl])(=O)=O)c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.609 |
| logD: | 4.5914 |
| logSw: | -4.7714 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.656 |
| InChI Key: | IDUOMZURRUQDCG-UHFFFAOYSA-N |