3-methoxy-6-nitro-4-[2-(propan-2-ylidene)hydrazinyl]-1,2-benzothiazole
Chemical Structure Depiction of
3-methoxy-6-nitro-4-[2-(propan-2-ylidene)hydrazinyl]-1,2-benzothiazole
3-methoxy-6-nitro-4-[2-(propan-2-ylidene)hydrazinyl]-1,2-benzothiazole
Compound characteristics
| Compound ID: | 8009-7201 |
| Compound Name: | 3-methoxy-6-nitro-4-[2-(propan-2-ylidene)hydrazinyl]-1,2-benzothiazole |
| Molecular Weight: | 280.3 |
| Molecular Formula: | C11 H12 N4 O3 S |
| Smiles: | CC(C)=NNc1cc(cc2c1c(ns2)OC)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.7575 |
| logD: | 3.757 |
| logSw: | -4.1606 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.909 |
| InChI Key: | XNCCIKUMTMTKGO-UHFFFAOYSA-N |