N-[2-(3-chloro-4-methoxyphenyl)-6-methyl-2H-benzotriazol-5-yl]-4-cyano-2-fluorobenzamide
Chemical Structure Depiction of
N-[2-(3-chloro-4-methoxyphenyl)-6-methyl-2H-benzotriazol-5-yl]-4-cyano-2-fluorobenzamide
N-[2-(3-chloro-4-methoxyphenyl)-6-methyl-2H-benzotriazol-5-yl]-4-cyano-2-fluorobenzamide
Compound characteristics
| Compound ID: | 7840-3923 |
| Compound Name: | N-[2-(3-chloro-4-methoxyphenyl)-6-methyl-2H-benzotriazol-5-yl]-4-cyano-2-fluorobenzamide |
| Molecular Weight: | 435.84 |
| Molecular Formula: | C22 H15 Cl F N5 O2 |
| Smiles: | Cc1cc2c(cc1NC(c1ccc(C#N)cc1F)=O)nn(c1ccc(c(c1)[Cl])OC)n2 |
| Stereo: | ACHIRAL |
| logP: | 4.5467 |
| logD: | 4.0558 |
| logSw: | -4.6881 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.353 |
| InChI Key: | VOCZDXQBTCXOGY-UHFFFAOYSA-N |