5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-{5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-carbonyl}furan-2-carboxamide
Chemical Structure Depiction of
5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-{5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-carbonyl}furan-2-carboxamide
5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-{5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-carbonyl}furan-2-carboxamide
Compound characteristics
| Compound ID: | Y502-4106 |
| Compound Name: | 5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-{5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-carbonyl}furan-2-carboxamide |
| Molecular Weight: | 579.25 |
| Molecular Formula: | C22 H21 Br2 N5 O4 |
| Smiles: | Cc1c(c(C)n(Cc2ccc(C(NC(c3ccc(Cn4c(C)c(c(C)n4)[Br])o3)=O)=O)o2)n1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.9572 |
| logD: | 2.8691 |
| logSw: | -3.2087 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.755 |
| InChI Key: | DARXTTMKTVEASL-UHFFFAOYSA-N |