N-(2,3-dihydro-1,4-benzodioxin-6-yl)-Nalpha-(2-oxo-1,2,3,4-tetrahydroquinoline-6-sulfonyl)phenylalaninamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-Nalpha-(2-oxo-1,2,3,4-tetrahydroquinoline-6-sulfonyl)phenylalaninamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-Nalpha-(2-oxo-1,2,3,4-tetrahydroquinoline-6-sulfonyl)phenylalaninamide
Compound characteristics
| Compound ID: | C597-0138 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-Nalpha-(2-oxo-1,2,3,4-tetrahydroquinoline-6-sulfonyl)phenylalaninamide |
| Molecular Weight: | 507.56 |
| Molecular Formula: | C26 H25 N3 O6 S |
| Smiles: | C1Cc2cc(ccc2NC1=O)S(NC(Cc1ccccc1)C(Nc1ccc2c(c1)OCCO2)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3492 |
| logD: | 2.3477 |
| logSw: | -3.0078 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 105.576 |
| InChI Key: | DTRGQBDIPNMDAG-QFIPXVFZSA-N |