N-(3-fluoro-4-methylphenyl)-1-propyl-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
N-(3-fluoro-4-methylphenyl)-1-propyl-1H-benzotriazole-5-carboxamide
N-(3-fluoro-4-methylphenyl)-1-propyl-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | F058-2119 |
| Compound Name: | N-(3-fluoro-4-methylphenyl)-1-propyl-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 312.34 |
| Molecular Formula: | C17 H17 F N4 O |
| Smiles: | CCCn1c2ccc(cc2nn1)C(Nc1ccc(C)c(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5664 |
| logD: | 3.5583 |
| logSw: | -3.6164 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.006 |
| InChI Key: | NOYXTCOZFTXTIB-UHFFFAOYSA-N |