methyl 2-{[1-(methanesulfonyl)-1,2,3,4-tetrahydroquinoline-6-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 2-{[1-(methanesulfonyl)-1,2,3,4-tetrahydroquinoline-6-carbonyl]amino}benzoate
methyl 2-{[1-(methanesulfonyl)-1,2,3,4-tetrahydroquinoline-6-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | D256-0778 |
| Compound Name: | methyl 2-{[1-(methanesulfonyl)-1,2,3,4-tetrahydroquinoline-6-carbonyl]amino}benzoate |
| Molecular Weight: | 388.44 |
| Molecular Formula: | C19 H20 N2 O5 S |
| Smiles: | COC(c1ccccc1NC(c1ccc2c(CCCN2S(C)(=O)=O)c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2098 |
| logD: | 1.3162 |
| logSw: | -3.1496 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.722 |
| InChI Key: | PUQNRGLUXAFDRI-UHFFFAOYSA-N |