N-(4-bromophenyl)-2-{[3-(3-methylbutyl)-4-oxo-3,4-dihydropteridin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(4-bromophenyl)-2-{[3-(3-methylbutyl)-4-oxo-3,4-dihydropteridin-2-yl]sulfanyl}acetamide
N-(4-bromophenyl)-2-{[3-(3-methylbutyl)-4-oxo-3,4-dihydropteridin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | E196-0235 |
| Compound Name: | N-(4-bromophenyl)-2-{[3-(3-methylbutyl)-4-oxo-3,4-dihydropteridin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 462.37 |
| Molecular Formula: | C19 H20 Br N5 O2 S |
| Smiles: | CC(C)CCN1C(=Nc2c(C1=O)nccn2)SCC(Nc1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.8779 |
| logD: | 3.8778 |
| logSw: | -3.8104 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.703 |
| InChI Key: | HKMCGYARXBMHCS-UHFFFAOYSA-N |