N-[(4-fluorophenyl)methyl]-4-({[5-(methoxymethyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-4-({[5-(methoxymethyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
N-[(4-fluorophenyl)methyl]-4-({[5-(methoxymethyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
Compound characteristics
| Compound ID: | V029-5617 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-4-({[5-(methoxymethyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide |
| Molecular Weight: | 476.57 |
| Molecular Formula: | C26 H25 F N4 O2 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)n1c(COC)nnc1SCc1ccc(cc1)C(NCc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.833 |
| logD: | 3.833 |
| logSw: | -3.9531 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.797 |
| InChI Key: | KUWZSBDZOYDXPI-UHFFFAOYSA-N |