N~1~-cyclohexyl-N~4~-[4-(7-methoxy-2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]butanediamide
Chemical Structure Depiction of
N~1~-cyclohexyl-N~4~-[4-(7-methoxy-2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]butanediamide
N~1~-cyclohexyl-N~4~-[4-(7-methoxy-2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]butanediamide
Compound characteristics
| Compound ID: | K232-1914 |
| Compound Name: | N~1~-cyclohexyl-N~4~-[4-(7-methoxy-2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]butanediamide |
| Molecular Weight: | 455.53 |
| Molecular Formula: | C23 H25 N3 O5 S |
| Smiles: | COc1ccc2C=C(C(=O)Oc2c1)c1csc(NC(CCC(NC2CCCCC2)=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.4211 |
| logD: | 3.41 |
| logSw: | -4.0539 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.553 |
| InChI Key: | XXXPTBJYKSOCBQ-UHFFFAOYSA-N |