N-[3-tert-butyl-1-(3-methylphenyl)-1H-pyrazol-5-yl]-N~2~-(3-methylbutyl)-N~2~-{[4-(methylsulfanyl)phenyl]carbamoyl}glycinamide
Chemical Structure Depiction of
N-[3-tert-butyl-1-(3-methylphenyl)-1H-pyrazol-5-yl]-N~2~-(3-methylbutyl)-N~2~-{[4-(methylsulfanyl)phenyl]carbamoyl}glycinamide
N-[3-tert-butyl-1-(3-methylphenyl)-1H-pyrazol-5-yl]-N~2~-(3-methylbutyl)-N~2~-{[4-(methylsulfanyl)phenyl]carbamoyl}glycinamide
Compound characteristics
| Compound ID: | V013-8119 |
| Compound Name: | N-[3-tert-butyl-1-(3-methylphenyl)-1H-pyrazol-5-yl]-N~2~-(3-methylbutyl)-N~2~-{[4-(methylsulfanyl)phenyl]carbamoyl}glycinamide |
| Molecular Weight: | 521.73 |
| Molecular Formula: | C29 H39 N5 O2 S |
| Smiles: | CC(C)CCN(CC(Nc1cc(C(C)(C)C)nn1c1cccc(C)c1)=O)C(Nc1ccc(cc1)SC)=O |
| Stereo: | ACHIRAL |
| logP: | 7.4031 |
| logD: | 7.4031 |
| logSw: | -5.5761 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.833 |
| InChI Key: | DBEKSCHKPQUXJA-UHFFFAOYSA-N |