N-[4-(3,4-dihydroquinoline-1(2H)-sulfonyl)phenyl]-3-methyl-2-nitrobenzamide
Chemical Structure Depiction of
N-[4-(3,4-dihydroquinoline-1(2H)-sulfonyl)phenyl]-3-methyl-2-nitrobenzamide
N-[4-(3,4-dihydroquinoline-1(2H)-sulfonyl)phenyl]-3-methyl-2-nitrobenzamide
Compound characteristics
| Compound ID: | Y032-4196 |
| Compound Name: | N-[4-(3,4-dihydroquinoline-1(2H)-sulfonyl)phenyl]-3-methyl-2-nitrobenzamide |
| Molecular Weight: | 451.5 |
| Molecular Formula: | C23 H21 N3 O5 S |
| Smiles: | Cc1cccc(C(Nc2ccc(cc2)S(N2CCCc3ccccc23)(=O)=O)=O)c1[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.2546 |
| logD: | 3.0617 |
| logSw: | -4.4595 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.262 |
| InChI Key: | YPYFLQSJNYWKBU-UHFFFAOYSA-N |