N-(2,4,4-trimethylpentan-2-yl)-1,2,3-benzothiadiazole-5-carboxamide
Chemical Structure Depiction of
N-(2,4,4-trimethylpentan-2-yl)-1,2,3-benzothiadiazole-5-carboxamide
N-(2,4,4-trimethylpentan-2-yl)-1,2,3-benzothiadiazole-5-carboxamide
Compound characteristics
| Compound ID: | D003-0030 |
| Compound Name: | N-(2,4,4-trimethylpentan-2-yl)-1,2,3-benzothiadiazole-5-carboxamide |
| Molecular Weight: | 291.41 |
| Molecular Formula: | C15 H21 N3 O S |
| Smiles: | CC(C)(C)CC(C)(C)NC(c1ccc2c(c1)nns2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8461 |
| logD: | 3.8461 |
| logSw: | -4.024 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.796 |
| InChI Key: | RHFOUDVLAGRSEK-UHFFFAOYSA-N |