N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-({1-[(2,4,6-trimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)urea
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-({1-[(2,4,6-trimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)urea
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-({1-[(2,4,6-trimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)urea
Compound characteristics
| Compound ID: | G331-0449 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-({1-[(2,4,6-trimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)urea |
| Molecular Weight: | 405.5 |
| Molecular Formula: | C24 H27 N3 O3 |
| Smiles: | Cc1cc(C)c(Cn2cccc2CNC(Nc2ccc3c(c2)OCCO3)=O)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.3494 |
| logD: | 4.3494 |
| logSw: | -4.3382 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.757 |
| InChI Key: | JFNGCAYIFTXSMI-UHFFFAOYSA-N |