methyl 2-{[1-(4-chlorobenzene-1-sulfonyl)-1,2,3,4-tetrahydroquinoline-6-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 2-{[1-(4-chlorobenzene-1-sulfonyl)-1,2,3,4-tetrahydroquinoline-6-carbonyl]amino}benzoate
methyl 2-{[1-(4-chlorobenzene-1-sulfonyl)-1,2,3,4-tetrahydroquinoline-6-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | D256-1203 |
| Compound Name: | methyl 2-{[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(c1ccccc1NC(c1ccc2c(CCCN2S(c2ccc(cc2)[Cl])(=O)=O)c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4411 |
| logD: | 3.5475 |
| logSw: | -4.5969 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.958 |
| InChI Key: | VPDFLPXRWYSSAC-UHFFFAOYSA-N |