5-[(5-bromothiophen-2-yl)methyl]-5-[2-(pyridin-4-yl)ethyl]-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
5-[(5-bromothiophen-2-yl)methyl]-5-[2-(pyridin-4-yl)ethyl]-1,3-diazinane-2,4,6-trione
5-[(5-bromothiophen-2-yl)methyl]-5-[2-(pyridin-4-yl)ethyl]-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | 8013-0606 |
| Compound Name: | 5-[(5-bromothiophen-2-yl)methyl]-5-[2-(pyridin-4-yl)ethyl]-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 408.27 |
| Molecular Formula: | C16 H14 Br N3 O3 S |
| Smiles: | C(CC1(Cc2ccc(s2)[Br])C(NC(NC1=O)=O)=O)c1ccncc1 |
| Stereo: | ACHIRAL |
| logP: | 2.4471 |
| logD: | 2.0488 |
| logSw: | -2.591 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.818 |
| InChI Key: | CUOCLFKSTRULMM-UHFFFAOYSA-N |