2-({5-[(naphthalen-1-yl)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-6-nitro-1,3-benzothiazole
Chemical Structure Depiction of
2-({5-[(naphthalen-1-yl)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-6-nitro-1,3-benzothiazole
2-({5-[(naphthalen-1-yl)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-6-nitro-1,3-benzothiazole
Compound characteristics
| Compound ID: | 8009-6374 |
| Compound Name: | 2-({5-[(naphthalen-1-yl)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-6-nitro-1,3-benzothiazole |
| Molecular Weight: | 495.58 |
| Molecular Formula: | C26 H17 N5 O2 S2 |
| Smiles: | C(c1cccc2ccccc12)c1nnc(n1c1ccccc1)Sc1nc2ccc(cc2s1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 6.7504 |
| logD: | 6.7504 |
| logSw: | -7.3083 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 67.88 |
| InChI Key: | BPIZOKZESXSZDE-UHFFFAOYSA-N |