N-(2-{[3-tert-butyl-1-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-N-[(furan-2-yl)methyl]-2-methoxybenzamide
Chemical Structure Depiction of
N-(2-{[3-tert-butyl-1-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-N-[(furan-2-yl)methyl]-2-methoxybenzamide
N-(2-{[3-tert-butyl-1-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-N-[(furan-2-yl)methyl]-2-methoxybenzamide
Compound characteristics
| Compound ID: | V012-1884 |
| Compound Name: | N-(2-{[3-tert-butyl-1-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-N-[(furan-2-yl)methyl]-2-methoxybenzamide |
| Molecular Weight: | 555.46 |
| Molecular Formula: | C28 H28 Cl2 N4 O4 |
| Smiles: | CC(C)(C)c1cc(NC(CN(Cc2ccco2)C(c2ccccc2OC)=O)=O)n(c2ccc(c(c2)[Cl])[Cl])n1 |
| Stereo: | ACHIRAL |
| logP: | 6.3008 |
| logD: | 6.3 |
| logSw: | -6.0877 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.141 |
| InChI Key: | ITWVESUHHQCRLS-UHFFFAOYSA-N |