N-(2H-1,3-benzodioxol-5-yl)-N'-{[1-(4-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}urea
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-N'-{[1-(4-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}urea
N-(2H-1,3-benzodioxol-5-yl)-N'-{[1-(4-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}urea
Compound characteristics
| Compound ID: | E983-1439 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-N'-{[1-(4-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}urea |
| Molecular Weight: | 393.44 |
| Molecular Formula: | C22 H23 N3 O4 |
| Smiles: | Cc1cc(CNC(Nc2ccc3c(c2)OCO3)=O)c(C)n1c1ccc(cc1)OC |
| Stereo: | ACHIRAL |
| logP: | 3.7452 |
| logD: | 3.7452 |
| logSw: | -4.0335 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.188 |
| InChI Key: | JSWFKGTZSZTZGG-UHFFFAOYSA-N |