5-{[1-(4-bromophenyl)-1H-pyrrol-2-yl]methylidene}-1-(2-fluorophenyl)-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
5-{[1-(4-bromophenyl)-1H-pyrrol-2-yl]methylidene}-1-(2-fluorophenyl)-1,3-diazinane-2,4,6-trione
5-{[1-(4-bromophenyl)-1H-pyrrol-2-yl]methylidene}-1-(2-fluorophenyl)-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | 3699-0505 |
| Compound Name: | 5-{[1-(4-bromophenyl)-1H-pyrrol-2-yl]methylidene}-1-(2-fluorophenyl)-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 454.25 |
| Molecular Formula: | C21 H13 Br F N3 O3 |
| Smiles: | C(=C1/C(NC(N(C1=O)c1ccccc1F)=O)=O)/c1cccn1c1ccc(cc1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.0828 |
| logD: | 3.2104 |
| logSw: | -4.3501 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.619 |
| InChI Key: | VNRKWQPMBDITBG-UHFFFAOYSA-N |