1-[(2H-1,3-benzodioxol-5-yl)methyl]-5-(4-bromophenyl)-3-hydroxy-4-(4-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Chemical Structure Depiction of
1-[(2H-1,3-benzodioxol-5-yl)methyl]-5-(4-bromophenyl)-3-hydroxy-4-(4-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
1-[(2H-1,3-benzodioxol-5-yl)methyl]-5-(4-bromophenyl)-3-hydroxy-4-(4-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Compound characteristics
| Compound ID: | F455-0644 |
| Compound Name: | 1-[(2H-1,3-benzodioxol-5-yl)methyl]-5-(4-bromophenyl)-3-hydroxy-4-(4-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one |
| Molecular Weight: | 494.34 |
| Molecular Formula: | C25 H20 Br N O5 |
| Smiles: | COc1ccc(cc1)C1C(c2ccc(cc2)[Br])N(Cc2ccc3c(c2)OCO3)C(C=1O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0087 |
| logD: | 5.0081 |
| logSw: | -4.5746 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.748 |
| InChI Key: | PFDKHZVEFONOOD-HSZRJFAPSA-N |