6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl N-(4-methylbenzene-1-sulfonyl)norvalinate
Chemical Structure Depiction of
6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl N-(4-methylbenzene-1-sulfonyl)norvalinate
6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl N-(4-methylbenzene-1-sulfonyl)norvalinate
Compound characteristics
| Compound ID: | Y041-4683 |
| Compound Name: | 6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl N-(4-methylbenzene-1-sulfonyl)norvalinate |
| Molecular Weight: | 526.01 |
| Molecular Formula: | C27 H24 Cl N O6 S |
| Smiles: | CCCC(C(=O)Oc1cc2c(cc1[Cl])C(=CC(=O)O2)c1ccccc1)NS(c1ccc(C)cc1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8594 |
| logD: | 5.8593 |
| logSw: | -5.937 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.712 |
| InChI Key: | KIRPXCLMRWDVEH-QHCPKHFHSA-N |