4-methyl-2-oxo-3-propyl-2H-1-benzopyran-7-yl N-(4-methylbenzene-1-sulfonyl)norvalinate
Chemical Structure Depiction of
4-methyl-2-oxo-3-propyl-2H-1-benzopyran-7-yl N-(4-methylbenzene-1-sulfonyl)norvalinate
4-methyl-2-oxo-3-propyl-2H-1-benzopyran-7-yl N-(4-methylbenzene-1-sulfonyl)norvalinate
Compound characteristics
| Compound ID: | Y040-8141 |
| Compound Name: | 4-methyl-2-oxo-3-propyl-2H-1-benzopyran-7-yl N-(4-methylbenzene-1-sulfonyl)norvalinate |
| Molecular Weight: | 471.57 |
| Molecular Formula: | C25 H29 N O6 S |
| Smiles: | CCCC(C(=O)Oc1ccc2C(C)=C(CCC)C(=O)Oc2c1)NS(c1ccc(C)cc1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6808 |
| logD: | 5.6808 |
| logSw: | -5.5002 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.412 |
| InChI Key: | NRUPTTMVFRIDQH-QFIPXVFZSA-N |