N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-{[1-(2-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}urea
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-{[1-(2-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}urea
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-{[1-(2-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}urea
Compound characteristics
| Compound ID: | E983-1898 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-{[1-(2-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}urea |
| Molecular Weight: | 407.47 |
| Molecular Formula: | C23 H25 N3 O4 |
| Smiles: | Cc1cc(CNC(Nc2ccc3c(c2)OCCO3)=O)c(C)n1c1ccccc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.6792 |
| logD: | 2.6791 |
| logSw: | -3.0981 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.681 |
| InChI Key: | YXSNDEQNERGKRQ-UHFFFAOYSA-N |