1-(ethanesulfonyl)-N-(2-methyl-3-nitrophenyl)-1,2,3,4-tetrahydroquinoline-6-carboxamide
Chemical Structure Depiction of
1-(ethanesulfonyl)-N-(2-methyl-3-nitrophenyl)-1,2,3,4-tetrahydroquinoline-6-carboxamide
1-(ethanesulfonyl)-N-(2-methyl-3-nitrophenyl)-1,2,3,4-tetrahydroquinoline-6-carboxamide
Compound characteristics
| Compound ID: | D348-0267 |
| Compound Name: | 1-(ethanesulfonyl)-N-(2-methyl-3-nitrophenyl)-1,2,3,4-tetrahydroquinoline-6-carboxamide |
| Molecular Weight: | 403.46 |
| Molecular Formula: | C19 H21 N3 O5 S |
| Smiles: | CCS(N1CCCc2cc(ccc12)C(Nc1cccc(c1C)[N+]([O-])=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7427 |
| logD: | 2.535 |
| logSw: | -3.4424 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.031 |
| InChI Key: | HJSPQUVOZWLNDA-UHFFFAOYSA-N |