2-(4-tert-butylphenyl)-4-({8-methyl-2-[(4-methylphenyl)sulfanyl]quinolin-3-yl}methylidene)-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(4-tert-butylphenyl)-4-({8-methyl-2-[(4-methylphenyl)sulfanyl]quinolin-3-yl}methylidene)-1,3-oxazol-5(4H)-one
2-(4-tert-butylphenyl)-4-({8-methyl-2-[(4-methylphenyl)sulfanyl]quinolin-3-yl}methylidene)-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 5141-0123 |
| Compound Name: | 2-(4-tert-butylphenyl)-4-({8-methyl-2-[(4-methylphenyl)sulfanyl]quinolin-3-yl}methylidene)-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 492.64 |
| Molecular Formula: | C31 H28 N2 O2 S |
| Smiles: | Cc1ccc(cc1)Sc1c(\C=C2/C(=O)OC(c3ccc(cc3)C(C)(C)C)=N2)cc2cccc(C)c2n1 |
| Stereo: | ACHIRAL |
| logP: | 8.8507 |
| logD: | 8.8507 |
| logSw: | -6.4661 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 39.337 |
| InChI Key: | CAWZADMEADXRAP-UHFFFAOYSA-N |