N-(1,2,3-benzothiadiazol-5-yl)-N'-(3-nitrophenyl)urea
Chemical Structure Depiction of
N-(1,2,3-benzothiadiazol-5-yl)-N'-(3-nitrophenyl)urea
N-(1,2,3-benzothiadiazol-5-yl)-N'-(3-nitrophenyl)urea
Compound characteristics
| Compound ID: | D003-0052 |
| Compound Name: | N-(1,2,3-benzothiadiazol-5-yl)-N'-(3-nitrophenyl)urea |
| Molecular Weight: | 315.31 |
| Molecular Formula: | C13 H9 N5 O3 S |
| Smiles: | c1cc(cc(c1)[N+]([O-])=O)NC(Nc1ccc2c(c1)nns2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7341 |
| logD: | 3.734 |
| logSw: | -4.067 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.504 |
| InChI Key: | QJWJHFXMJLLDEW-UHFFFAOYSA-N |