1-(2,1,3-benzothiadiazole-4-sulfonyl)-N-(2-methoxy-5-nitrophenyl)prolinamide
Chemical Structure Depiction of
1-(2,1,3-benzothiadiazole-4-sulfonyl)-N-(2-methoxy-5-nitrophenyl)prolinamide
1-(2,1,3-benzothiadiazole-4-sulfonyl)-N-(2-methoxy-5-nitrophenyl)prolinamide
Compound characteristics
| Compound ID: | C548-3238 |
| Compound Name: | 1-(2,1,3-benzothiadiazole-4-sulfonyl)-N-(2-methoxy-5-nitrophenyl)prolinamide |
| Molecular Weight: | 463.49 |
| Molecular Formula: | C18 H17 N5 O6 S2 |
| Smiles: | COc1ccc(cc1NC(C1CCCN1S(c1cccc2c1nsn2)(=O)=O)=O)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4377 |
| logD: | 2.0895 |
| logSw: | -3.0172 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 117.144 |
| InChI Key: | DPZHOXBVVRRWCX-AWEZNQCLSA-N |