2-[(2,1,3-benzothiadiazole-4-sulfonyl)amino]-5-chloro-N-[4-(cyanomethyl)phenyl]benzamide
Chemical Structure Depiction of
2-[(2,1,3-benzothiadiazole-4-sulfonyl)amino]-5-chloro-N-[4-(cyanomethyl)phenyl]benzamide
2-[(2,1,3-benzothiadiazole-4-sulfonyl)amino]-5-chloro-N-[4-(cyanomethyl)phenyl]benzamide
Compound characteristics
| Compound ID: | 0141-0290 |
| Compound Name: | 2-[(2,1,3-benzothiadiazole-4-sulfonyl)amino]-5-chloro-N-[4-(cyanomethyl)phenyl]benzamide |
| Molecular Weight: | 483.95 |
| Molecular Formula: | C21 H14 Cl N5 O3 S2 |
| Smiles: | C(C#N)c1ccc(cc1)NC(c1cc(ccc1NS(c1cccc2c1nsn2)(=O)=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.7037 |
| logD: | 2.0068 |
| logSw: | -4.3845 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 101.726 |
| InChI Key: | QONQHVSNLFKJGV-UHFFFAOYSA-N |