6-methyl-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl N-(4-methylbenzene-1-sulfonyl)-L-tryptophanate
Chemical Structure Depiction of
6-methyl-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl N-(4-methylbenzene-1-sulfonyl)-L-tryptophanate
6-methyl-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl N-(4-methylbenzene-1-sulfonyl)-L-tryptophanate
Compound characteristics
| Compound ID: | Y041-1495 |
| Compound Name: | 6-methyl-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl N-(4-methylbenzene-1-sulfonyl)-L-tryptophanate |
| Molecular Weight: | 556.64 |
| Molecular Formula: | C31 H28 N2 O6 S |
| Smiles: | Cc1ccc(cc1)S(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)Oc1ccc2C3CCCC=3C(=O)Oc2c1C)(=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 5.7188 |
| logD: | 5.7188 |
| logSw: | -5.6803 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.068 |
| InChI Key: | WTTOTDBCLJBONA-MHZLTWQESA-N |