N~1~-[4-(7-methoxy-2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]-N~4~-[2-(2-methylpiperidin-1-yl)ethyl]butanediamide
Chemical Structure Depiction of
N~1~-[4-(7-methoxy-2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]-N~4~-[2-(2-methylpiperidin-1-yl)ethyl]butanediamide
N~1~-[4-(7-methoxy-2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]-N~4~-[2-(2-methylpiperidin-1-yl)ethyl]butanediamide
Compound characteristics
| Compound ID: | K232-1891 |
| Compound Name: | N~1~-[4-(7-methoxy-2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]-N~4~-[2-(2-methylpiperidin-1-yl)ethyl]butanediamide |
| Molecular Weight: | 498.6 |
| Molecular Formula: | C25 H30 N4 O5 S |
| Smiles: | CC1CCCCN1CCNC(CCC(Nc1nc(cs1)C1=Cc2ccc(cc2OC1=O)OC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1549 |
| logD: | 0.182 |
| logSw: | -2.9927 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.103 |
| InChI Key: | KNAABXGHXXYXBI-INIZCTEOSA-N |