4-azido-6-nitro-2-phenyl-1,2-benzothiazol-3(2H)-one
Chemical Structure Depiction of
4-azido-6-nitro-2-phenyl-1,2-benzothiazol-3(2H)-one
4-azido-6-nitro-2-phenyl-1,2-benzothiazol-3(2H)-one
Compound characteristics
| Compound ID: | 8009-9623 |
| Compound Name: | 4-azido-6-nitro-2-phenyl-1,2-benzothiazol-3(2H)-one |
| Molecular Weight: | 313.29 |
| Molecular Formula: | C13 H7 N5 O3 S |
| Smiles: | c1ccc(cc1)N1C(c2c(cc(cc2S1)[N+]([O-])=O)N=[N+]=[N-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.0042 |
| logD: | 3.0042 |
| logSw: | -3.521 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 90.449 |
| InChI Key: | AYZDQVYNYJBLIC-UHFFFAOYSA-N |