3-bromo-N-(2-{[3-tert-butyl-1-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-N-(2-methoxyethyl)benzamide
Chemical Structure Depiction of
3-bromo-N-(2-{[3-tert-butyl-1-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-N-(2-methoxyethyl)benzamide
3-bromo-N-(2-{[3-tert-butyl-1-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-N-(2-methoxyethyl)benzamide
Compound characteristics
| Compound ID: | V004-0200 |
| Compound Name: | 3-bromo-N-(2-{[3-tert-butyl-1-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-N-(2-methoxyethyl)benzamide |
| Molecular Weight: | 541.49 |
| Molecular Formula: | C27 H33 Br N4 O3 |
| Salt: | not_available |
| Smiles: | Cc1ccc(c(C)c1)n1c(cc(C(C)(C)C)n1)NC(CN(CCOC)C(c1cccc(c1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9597 |
| logD: | 5.9594 |
| logSw: | -5.4307 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.054 |
| InChI Key: | SBTRGQGEDBEHQQ-UHFFFAOYSA-N |