N-{[1-(3-methylbutanoyl)-2,3-dihydro-1H-indol-5-yl]methyl}-2,1,3-benzothiadiazole-4-sulfonamide
Chemical Structure Depiction of
N-{[1-(3-methylbutanoyl)-2,3-dihydro-1H-indol-5-yl]methyl}-2,1,3-benzothiadiazole-4-sulfonamide
N-{[1-(3-methylbutanoyl)-2,3-dihydro-1H-indol-5-yl]methyl}-2,1,3-benzothiadiazole-4-sulfonamide
Compound characteristics
| Compound ID: | G810-0644 |
| Compound Name: | N-{[1-(3-methylbutanoyl)-2,3-dihydro-1H-indol-5-yl]methyl}-2,1,3-benzothiadiazole-4-sulfonamide |
| Molecular Weight: | 430.55 |
| Molecular Formula: | C20 H22 N4 O3 S2 |
| Smiles: | CC(C)CC(N1CCc2cc(CNS(c3cccc4c3nsn4)(=O)=O)ccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6166 |
| logD: | 3.5947 |
| logSw: | -3.8936 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.372 |
| InChI Key: | NRCRVUGMZMTRBX-UHFFFAOYSA-N |