4-ethyl-2-oxo-2H-1-benzopyran-7-yl N-(4-methylbenzene-1-sulfonyl)-L-tryptophanate
Chemical Structure Depiction of
4-ethyl-2-oxo-2H-1-benzopyran-7-yl N-(4-methylbenzene-1-sulfonyl)-L-tryptophanate
4-ethyl-2-oxo-2H-1-benzopyran-7-yl N-(4-methylbenzene-1-sulfonyl)-L-tryptophanate
Compound characteristics
| Compound ID: | Y041-1645 |
| Compound Name: | 4-ethyl-2-oxo-2H-1-benzopyran-7-yl N-(4-methylbenzene-1-sulfonyl)-L-tryptophanate |
| Molecular Weight: | 530.6 |
| Molecular Formula: | C29 H26 N2 O6 S |
| Smiles: | CCC1=CC(=O)Oc2cc(ccc12)OC([C@H](Cc1c[nH]c2ccccc12)NS(c1ccc(C)cc1)(=O)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 5.3636 |
| logD: | 5.3636 |
| logSw: | -5.5879 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.496 |
| InChI Key: | CFOIFOCZOQJFHW-SANMLTNESA-N |