2-(4-tert-butylphenyl)-4-({2-[(4-chlorophenyl)sulfanyl]quinolin-3-yl}methylidene)-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(4-tert-butylphenyl)-4-({2-[(4-chlorophenyl)sulfanyl]quinolin-3-yl}methylidene)-1,3-oxazol-5(4H)-one
2-(4-tert-butylphenyl)-4-({2-[(4-chlorophenyl)sulfanyl]quinolin-3-yl}methylidene)-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 5141-0117 |
| Compound Name: | 2-(4-tert-butylphenyl)-4-({2-[(4-chlorophenyl)sulfanyl]quinolin-3-yl}methylidene)-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 499.03 |
| Molecular Formula: | C29 H23 Cl N2 O2 S |
| Smiles: | CC(C)(C)c1ccc(cc1)C1=NC(=C\c2cc3ccccc3nc2Sc2ccc(cc2)[Cl])\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 8.5045 |
| logD: | 8.5045 |
| logSw: | -6.6769 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 38.566 |
| InChI Key: | JXGBWRCZEPNGQQ-UHFFFAOYSA-N |