N-{1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-[(3-hydroxypropyl)amino]-3-oxoprop-1-en-2-yl}-2-methoxybenzamide
Chemical Structure Depiction of
N-{1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-[(3-hydroxypropyl)amino]-3-oxoprop-1-en-2-yl}-2-methoxybenzamide
N-{1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-[(3-hydroxypropyl)amino]-3-oxoprop-1-en-2-yl}-2-methoxybenzamide
Compound characteristics
| Compound ID: | D009-0095 |
| Compound Name: | N-{1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-[(3-hydroxypropyl)amino]-3-oxoprop-1-en-2-yl}-2-methoxybenzamide |
| Molecular Weight: | 500.57 |
| Molecular Formula: | C24 H28 N4 O6 S |
| Smiles: | CN(C)S(n1cc(/C=C(/C(NCCCO)=O)NC(c2ccccc2OC)=O)c2ccccc12)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.012 |
| logD: | -1.6915 |
| logSw: | -2.2759 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 104.327 |
| InChI Key: | BETNZWZZZCPSKK-UHFFFAOYSA-N |