methyl 2-{[1-(methanesulfonyl)-1,2,3,4-tetrahydroquinoline-6-carbonyl]amino}-4,5-dimethoxybenzoate
Chemical Structure Depiction of
methyl 2-{[1-(methanesulfonyl)-1,2,3,4-tetrahydroquinoline-6-carbonyl]amino}-4,5-dimethoxybenzoate
methyl 2-{[1-(methanesulfonyl)-1,2,3,4-tetrahydroquinoline-6-carbonyl]amino}-4,5-dimethoxybenzoate
Compound characteristics
| Compound ID: | D256-0831 |
| Compound Name: | methyl 2-{[1-(methanesulfonyl)-1,2,3,4-tetrahydroquinoline-6-carbonyl]amino}-4,5-dimethoxybenzoate |
| Molecular Weight: | 448.49 |
| Molecular Formula: | C21 H24 N2 O7 S |
| Smiles: | COC(c1cc(c(cc1NC(c1ccc2c(CCCN2S(C)(=O)=O)c1)=O)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8853 |
| logD: | -0.2548 |
| logSw: | -2.8611 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.983 |
| InChI Key: | QTHCFSWGIABPOZ-UHFFFAOYSA-N |