methyl 4-[(6-ethyl-4-oxo-2,3,4,9-tetrahydro-1H-carbazole-7-sulfonyl)amino]benzoate
Chemical Structure Depiction of
methyl 4-[(6-ethyl-4-oxo-2,3,4,9-tetrahydro-1H-carbazole-7-sulfonyl)amino]benzoate
methyl 4-[(6-ethyl-4-oxo-2,3,4,9-tetrahydro-1H-carbazole-7-sulfonyl)amino]benzoate
Compound characteristics
| Compound ID: | G261-1430 |
| Compound Name: | methyl 4-[(6-ethyl-4-oxo-2,3,4,9-tetrahydro-1H-carbazole-7-sulfonyl)amino]benzoate |
| Molecular Weight: | 426.49 |
| Molecular Formula: | C22 H22 N2 O5 S |
| Smiles: | CCc1cc2c3C(CCCc3[nH]c2cc1S(Nc1ccc(cc1)C(=O)OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8218 |
| logD: | 2.2704 |
| logSw: | -4.3592 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.08 |
| InChI Key: | KYYZTKPZHZTTAG-UHFFFAOYSA-N |