N-[2-(7-chloro-2-methyl-1H-indol-3-yl)ethyl]-3,5-dinitrobenzamide
Chemical Structure Depiction of
N-[2-(7-chloro-2-methyl-1H-indol-3-yl)ethyl]-3,5-dinitrobenzamide
N-[2-(7-chloro-2-methyl-1H-indol-3-yl)ethyl]-3,5-dinitrobenzamide
Compound characteristics
| Compound ID: | 8014-1159 |
| Compound Name: | N-[2-(7-chloro-2-methyl-1H-indol-3-yl)ethyl]-3,5-dinitrobenzamide |
| Molecular Weight: | 402.79 |
| Molecular Formula: | C18 H15 Cl N4 O5 |
| Smiles: | Cc1c(CCNC(c2cc(cc(c2)[N+]([O-])=O)[N+]([O-])=O)=O)c2cccc(c2[nH]1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.7825 |
| logD: | 3.7823 |
| logSw: | -4.2807 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 101.953 |
| InChI Key: | GWIFYTXFVJTXGI-UHFFFAOYSA-N |