2-(4-tert-butylphenyl)-4-{[7-methyl-2-(phenylsulfanyl)quinolin-3-yl]methylidene}-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(4-tert-butylphenyl)-4-{[7-methyl-2-(phenylsulfanyl)quinolin-3-yl]methylidene}-1,3-oxazol-5(4H)-one
2-(4-tert-butylphenyl)-4-{[7-methyl-2-(phenylsulfanyl)quinolin-3-yl]methylidene}-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 5141-0129 |
| Compound Name: | 2-(4-tert-butylphenyl)-4-{[7-methyl-2-(phenylsulfanyl)quinolin-3-yl]methylidene}-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 478.61 |
| Molecular Formula: | C30 H26 N2 O2 S |
| Smiles: | Cc1ccc2cc(\C=C3/C(=O)OC(c4ccc(cc4)C(C)(C)C)=N3)c(nc2c1)Sc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 8.2756 |
| logD: | 8.2756 |
| logSw: | -5.9927 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 38.566 |
| InChI Key: | ZBPXTISKXCGDHS-UHFFFAOYSA-N |