4-(2-anilino-1,3-thiazol-4-yl)-4-(ethoxycarbonyl)octanoic acid
Chemical Structure Depiction of
4-(2-anilino-1,3-thiazol-4-yl)-4-(ethoxycarbonyl)octanoic acid
4-(2-anilino-1,3-thiazol-4-yl)-4-(ethoxycarbonyl)octanoic acid
Compound characteristics
| Compound ID: | 4732-0049 |
| Compound Name: | 4-(2-anilino-1,3-thiazol-4-yl)-4-(ethoxycarbonyl)octanoic acid |
| Molecular Weight: | 390.5 |
| Molecular Formula: | C20 H26 N2 O4 S |
| Smiles: | CCCCC(CCC(O)=O)(C(=O)OCC)c1csc(Nc2ccccc2)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2533 |
| logD: | 2.3009 |
| logSw: | -4.8557 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.335 |
| InChI Key: | BQBLDUOCIMPGKJ-HXUWFJFHSA-N |