3-methyl-N-(4-{[(3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}phenyl)thiophene-2-carboxamide
Chemical Structure Depiction of
3-methyl-N-(4-{[(3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}phenyl)thiophene-2-carboxamide
3-methyl-N-(4-{[(3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}phenyl)thiophene-2-carboxamide
Compound characteristics
| Compound ID: | L780-0141 |
| Compound Name: | 3-methyl-N-(4-{[(3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}phenyl)thiophene-2-carboxamide |
| Molecular Weight: | 407.51 |
| Molecular Formula: | C21 H17 N3 O2 S2 |
| Smiles: | Cc1ccsc1C(Nc1ccc(cc1)SCC1C(Nc2ccccc2N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1809 |
| logD: | 4.1808 |
| logSw: | -4.2069 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.966 |
| InChI Key: | WDIZAQDANCWNDP-UHFFFAOYSA-N |