N-(2-{[3-tert-butyl-1-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-2-chloro-N-pentylbenzamide
Chemical Structure Depiction of
N-(2-{[3-tert-butyl-1-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-2-chloro-N-pentylbenzamide
N-(2-{[3-tert-butyl-1-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-2-chloro-N-pentylbenzamide
Compound characteristics
| Compound ID: | V010-8156 |
| Compound Name: | N-(2-{[3-tert-butyl-1-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-2-chloro-N-pentylbenzamide |
| Molecular Weight: | 509.09 |
| Molecular Formula: | C29 H37 Cl N4 O2 |
| Smiles: | CCCCCN(CC(Nc1cc(C(C)(C)C)nn1c1ccc(C)cc1C)=O)C(c1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 7.6658 |
| logD: | 7.6655 |
| logSw: | -6.3436 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.711 |
| InChI Key: | PCAIJAAYWUDVHR-UHFFFAOYSA-N |