3-bromo-N-(2-{[3-tert-butyl-1-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-N-methylbenzamide
Chemical Structure Depiction of
3-bromo-N-(2-{[3-tert-butyl-1-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-N-methylbenzamide
3-bromo-N-(2-{[3-tert-butyl-1-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-N-methylbenzamide
Compound characteristics
| Compound ID: | V027-2506 |
| Compound Name: | 3-bromo-N-(2-{[3-tert-butyl-1-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-N-methylbenzamide |
| Molecular Weight: | 497.43 |
| Molecular Formula: | C25 H29 Br N4 O2 |
| Salt: | not_available |
| Smiles: | Cc1ccc(c(C)c1)n1c(cc(C(C)(C)C)n1)NC(CN(C)C(c1cccc(c1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9291 |
| logD: | 5.9287 |
| logSw: | -5.4407 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.672 |
| InChI Key: | QAVKHTXGYGKUOS-UHFFFAOYSA-N |