N-(2-{[3-tert-butyl-1-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-N-[(furan-2-yl)methyl]-3-methylbutanamide
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]-3-methylbutanamide
N-(2-{[3-tert-butyl-1-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-N-[(furan-2-yl)methyl]-3-methylbutanamide
Compound characteristics
| Compound ID: | V004-0191 |
| Compound Name: | N-(2-{[3-tert-butyl-1-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-N-[(furan-2-yl)methyl]-3-methylbutanamide |
| Molecular Weight: | 505.44 |
| Molecular Formula: | C25 H30 Cl2 N4 O3 |
| Smiles: | CC(C)CC(N(CC(Nc1cc(C(C)(C)C)nn1c1ccc(c(c1)[Cl])[Cl])=O)Cc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4105 |
| logD: | 6.409 |
| logSw: | -6.2764 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.255 |
| InChI Key: | QKJBAFDWZVQGJO-UHFFFAOYSA-N |