N-[2-({5-bromo-4-[(4-fluorophenyl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)phenyl]-N'-(3-methoxyphenyl)urea
Chemical Structure Depiction of
N-[2-({5-bromo-4-[(4-fluorophenyl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)phenyl]-N'-(3-methoxyphenyl)urea
N-[2-({5-bromo-4-[(4-fluorophenyl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)phenyl]-N'-(3-methoxyphenyl)urea
Compound characteristics
| Compound ID: | C301-9197 |
| Compound Name: | N-[2-({5-bromo-4-[(4-fluorophenyl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)phenyl]-N'-(3-methoxyphenyl)urea |
| Molecular Weight: | 528.4 |
| Molecular Formula: | C23 H19 Br F N5 O2 S |
| Smiles: | COc1cccc(c1)NC(Nc1ccccc1Sc1nnc(n1Cc1ccc(cc1)F)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.6255 |
| logD: | 5.6255 |
| logSw: | -5.3946 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.99 |
| InChI Key: | LEPISFIEAMITDQ-UHFFFAOYSA-N |