N-{amino[(1,3-benzothiazol-2-yl)amino]methylidene}-2-chloro-5-nitrobenzamide
Chemical Structure Depiction of
N-{amino[(1,3-benzothiazol-2-yl)amino]methylidene}-2-chloro-5-nitrobenzamide
N-{amino[(1,3-benzothiazol-2-yl)amino]methylidene}-2-chloro-5-nitrobenzamide
Compound characteristics
| Compound ID: | Y021-1508 |
| Compound Name: | N-{amino[(1,3-benzothiazol-2-yl)amino]methylidene}-2-chloro-5-nitrobenzamide |
| Molecular Weight: | 375.79 |
| Molecular Formula: | C15 H10 Cl N5 O3 S |
| Smiles: | c1ccc2c(c1)nc(NC(/N)=N/C(c1cc(ccc1[Cl])[N+]([O-])=O)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 3.7621 |
| logD: | 2.8923 |
| logSw: | -4.3822 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 95.51 |
| InChI Key: | HNPYNKSOYUUYKT-UHFFFAOYSA-N |