TL;DR: 4-bromo-N-methyl-1H-pyrrole-2-carboxamide (CAS 132911-43-4) is a chemical compound with molecular formula C6H7BrN2O and molecular weight 201.97418 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-bromo-N-methyl-1H-pyrrole-2-carboxamide
Also Known As: 4-bromo-N-methyl-1H-pyrrole-2-carboxamide, CBP006, 1H-Pyrrole-2-carboxamide, 4-bromo-N-methyl-, N-Methyl-4-bromo-1H-pyrrole-2-carboxamide, J2.809.188E
| Molecular Formula | C6H7BrN2O |
| Molecular Weight | 201.97418 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 44.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 201.97418 Da |
| Heavy Atoms | 10 |
| Complexity | 140.0 |
| SMILES | CNC(=O)C1=CC(=CN1)Br |
| InChIKey | HQGRBJIXXLIGLE-UHFFFAOYSA-N |
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-bromo-N-methyl-1H-pyrrole-2-carboxamide. With a topological polar surface area (TPSA) of 44.9 Ų, 4-bromo-N-methyl-1H-pyrrole-2-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-bromo-N-methyl-1H-pyrrole-2-carboxamide has 2 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-bromo-N-methyl-1H-pyrrole-2-carboxamide is 132911-43-4.
The molecular formula of 4-bromo-N-methyl-1H-pyrrole-2-carboxamide is C6H7BrN2O.
The molecular weight of 4-bromo-N-methyl-1H-pyrrole-2-carboxamide is 201.97418 g/mol.
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