N-[3-{[3-(1H-imidazol-1-yl)propyl]amino}-1-(1-methyl-1H-indol-3-yl)-3-oxoprop-1-en-2-yl]-3,4,5-trimethoxybenzamide
Chemical Structure Depiction of
N-[3-{[3-(1H-imidazol-1-yl)propyl]amino}-1-(1-methyl-1H-indol-3-yl)-3-oxoprop-1-en-2-yl]-3,4,5-trimethoxybenzamide
N-[3-{[3-(1H-imidazol-1-yl)propyl]amino}-1-(1-methyl-1H-indol-3-yl)-3-oxoprop-1-en-2-yl]-3,4,5-trimethoxybenzamide
Compound characteristics
| Compound ID: | D009-0466 |
| Compound Name: | N-[3-{[3-(1H-imidazol-1-yl)propyl]amino}-1-(1-methyl-1H-indol-3-yl)-3-oxoprop-1-en-2-yl]-3,4,5-trimethoxybenzamide |
| Molecular Weight: | 517.58 |
| Molecular Formula: | C28 H31 N5 O5 |
| Smiles: | Cn1cc(/C=C(/C(NCCCn2ccnc2)=O)NC(c2cc(c(c(c2)OC)OC)OC)=O)c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 2.1151 |
| logD: | 1.8532 |
| logSw: | -3.0986 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.756 |
| InChI Key: | RJKPYJLGEUYPBY-UHFFFAOYSA-N |