N-(4-bromophenyl)-N'-(4-{[(3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}phenyl)urea
Chemical Structure Depiction of
N-(4-bromophenyl)-N'-(4-{[(3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}phenyl)urea
N-(4-bromophenyl)-N'-(4-{[(3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}phenyl)urea
Compound characteristics
| Compound ID: | L781-0106 |
| Compound Name: | N-(4-bromophenyl)-N'-(4-{[(3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}phenyl)urea |
| Molecular Weight: | 481.37 |
| Molecular Formula: | C22 H17 Br N4 O2 S |
| Smiles: | C(C1C(Nc2ccccc2N=1)=O)Sc1ccc(cc1)NC(Nc1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.4661 |
| logD: | 5.466 |
| logSw: | -5.6847 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 65.16 |
| InChI Key: | NDCDLYHUTBYVGE-UHFFFAOYSA-N |