5-bromo-3-{[4-(methylsulfanyl)phenyl]methylidene}-1,3-dihydro-2H-indol-2-one
Chemical Structure Depiction of
5-bromo-3-{[4-(methylsulfanyl)phenyl]methylidene}-1,3-dihydro-2H-indol-2-one
5-bromo-3-{[4-(methylsulfanyl)phenyl]methylidene}-1,3-dihydro-2H-indol-2-one
Compound characteristics
| Compound ID: | 4896-5304 |
| Compound Name: | 5-bromo-3-{[4-(methylsulfanyl)phenyl]methylidene}-1,3-dihydro-2H-indol-2-one |
| Molecular Weight: | 346.24 |
| Molecular Formula: | C16 H12 Br N O S |
| Smiles: | CSc1ccc(/C=C2C(Nc3ccc(cc/23)[Br])=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.8832 |
| logD: | 4.8832 |
| logSw: | -4.61 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 25.2104 |
| InChI Key: | OOIUIJRCLGTMEK-UHFFFAOYSA-N |