ethyl 4-{[1-(2,1,3-benzothiadiazole-4-sulfonyl)prolyl]amino}benzoate
Chemical Structure Depiction of
ethyl 4-{[1-(2,1,3-benzothiadiazole-4-sulfonyl)prolyl]amino}benzoate
ethyl 4-{[1-(2,1,3-benzothiadiazole-4-sulfonyl)prolyl]amino}benzoate
Compound characteristics
| Compound ID: | C548-3199 |
| Compound Name: | ethyl 4-{[1-(2,1,3-benzothiadiazole-4-sulfonyl)prolyl]amino}benzoate |
| Molecular Weight: | 460.53 |
| Molecular Formula: | C20 H20 N4 O5 S2 |
| Smiles: | CCOC(c1ccc(cc1)NC(C1CCCN1S(c1cccc2c1nsn2)(=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1489 |
| logD: | 3.1467 |
| logSw: | -3.3657 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.584 |
| InChI Key: | OZJJKXNKNSIXMI-INIZCTEOSA-N |