N-[5-(2H-1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-Nalpha-nonanoylphenylalaninamide
Chemical Structure Depiction of
N-[5-(2H-1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-Nalpha-nonanoylphenylalaninamide
N-[5-(2H-1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-Nalpha-nonanoylphenylalaninamide
Compound characteristics
| Compound ID: | V025-3540 |
| Compound Name: | N-[5-(2H-1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-Nalpha-nonanoylphenylalaninamide |
| Molecular Weight: | 508.64 |
| Molecular Formula: | C27 H32 N4 O4 S |
| Salt: | not_available |
| Smiles: | CCCCCCCCC(NC(Cc1ccccc1)C(Nc1nnc(c2ccc3c(c2)OCO3)s1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.5842 |
| logD: | 6.5832 |
| logSw: | -5.5537 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.82 |
| InChI Key: | KAPNZXXNXXOLGP-NRFANRHFSA-N |