5-bromo-N-(5-{[(3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)furan-2-carboxamide
Chemical Structure Depiction of
5-bromo-N-(5-{[(3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)furan-2-carboxamide
5-bromo-N-(5-{[(3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)furan-2-carboxamide
Compound characteristics
| Compound ID: | L784-0039 |
| Compound Name: | 5-bromo-N-(5-{[(3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)furan-2-carboxamide |
| Molecular Weight: | 464.32 |
| Molecular Formula: | C16 H10 Br N5 O3 S2 |
| Smiles: | C(C1C(Nc2ccccc2N=1)=O)Sc1nnc(NC(c2ccc(o2)[Br])=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.6683 |
| logD: | 3.1022 |
| logSw: | -4.0182 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.78 |
| InChI Key: | MIJPYUSTLCGFSH-UHFFFAOYSA-N |