N~3~-(2,1,3-benzothiadiazole-4-sulfonyl)-N-[(furan-2-yl)methyl]-beta-alaninamide
Chemical Structure Depiction of
N~3~-(2,1,3-benzothiadiazole-4-sulfonyl)-N-[(furan-2-yl)methyl]-beta-alaninamide
N~3~-(2,1,3-benzothiadiazole-4-sulfonyl)-N-[(furan-2-yl)methyl]-beta-alaninamide
Compound characteristics
| Compound ID: | C105-2653 |
| Compound Name: | N~3~-(2,1,3-benzothiadiazole-4-sulfonyl)-N-[(furan-2-yl)methyl]-beta-alaninamide |
| Molecular Weight: | 366.42 |
| Molecular Formula: | C14 H14 N4 O4 S2 |
| Smiles: | C(CNS(c1cccc2c1nsn2)(=O)=O)C(NCc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7765 |
| logD: | 1.7725 |
| logSw: | -2.4076 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 95.011 |
| InChI Key: | MGYYQICOUKCXOJ-UHFFFAOYSA-N |