4-({2-[(4-chlorophenyl)sulfanyl]quinolin-3-yl}methylidene)-2-(3,4-dimethoxyphenyl)-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-({2-[(4-chlorophenyl)sulfanyl]quinolin-3-yl}methylidene)-2-(3,4-dimethoxyphenyl)-1,3-oxazol-5(4H)-one
4-({2-[(4-chlorophenyl)sulfanyl]quinolin-3-yl}methylidene)-2-(3,4-dimethoxyphenyl)-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 5141-0201 |
| Compound Name: | 4-({2-[(4-chlorophenyl)sulfanyl]quinolin-3-yl}methylidene)-2-(3,4-dimethoxyphenyl)-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 502.98 |
| Molecular Formula: | C27 H19 Cl N2 O4 S |
| Smiles: | COc1ccc(cc1OC)C1=NC(=C\c2cc3ccccc3nc2Sc2ccc(cc2)[Cl])\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 6.3085 |
| logD: | 6.3085 |
| logSw: | -6.4571 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 53.827 |
| InChI Key: | TVAXXHKXDUCIHU-UHFFFAOYSA-N |