Nalpha-(2,1,3-benzothiadiazole-4-sulfonyl)-N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]phenylalaninamide
Chemical Structure Depiction of
Nalpha-(2,1,3-benzothiadiazole-4-sulfonyl)-N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]phenylalaninamide
Nalpha-(2,1,3-benzothiadiazole-4-sulfonyl)-N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]phenylalaninamide
Compound characteristics
| Compound ID: | C481-1844 |
| Compound Name: | Nalpha-(2,1,3-benzothiadiazole-4-sulfonyl)-N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]phenylalaninamide |
| Molecular Weight: | 510.59 |
| Molecular Formula: | C24 H22 N4 O5 S2 |
| Smiles: | C(C(C(NCC1COc2ccccc2O1)=O)NS(c1cccc2c1nsn2)(=O)=O)c1ccccc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.3893 |
| logD: | 3.3833 |
| logSw: | -3.7042 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 102.886 |
| InChI Key: | IQTGRHIIHASNLA-UHFFFAOYSA-N |