methyl [3-(3,4-dihydroquinoline-1(2H)-sulfonyl)-5-nitro-1H-indol-1-yl]acetate
Chemical Structure Depiction of
methyl [3-(3,4-dihydroquinoline-1(2H)-sulfonyl)-5-nitro-1H-indol-1-yl]acetate
methyl [3-(3,4-dihydroquinoline-1(2H)-sulfonyl)-5-nitro-1H-indol-1-yl]acetate
Compound characteristics
| Compound ID: | E734-2072 |
| Compound Name: | methyl [3-(3,4-dihydroquinoline-1(2H)-sulfonyl)-5-nitro-1H-indol-1-yl]acetate |
| Molecular Weight: | 429.45 |
| Molecular Formula: | C20 H19 N3 O6 S |
| Smiles: | COC(Cn1cc(c2cc(ccc12)[N+]([O-])=O)S(N1CCCc2ccccc12)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6408 |
| logD: | 2.6408 |
| logSw: | -3.067 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 87.355 |
| InChI Key: | BSDDZSJFOIVULW-UHFFFAOYSA-N |