TL;DR: N-[4-(azepan-1-ylsulfonyl)phenyl]-1,5-dimethylpyrazole-4-carboxamide (CAS 492423-00-4) is a chemical compound with molecular formula C18H24N4O3S and molecular weight 376.15692 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[4-(azepan-1-ylsulfonyl)phenyl]-1,5-dimethylpyrazole-4-carboxamide
Also Known As: N-[4-(azepan-1-ylsulfonyl)phenyl]-1,5-dimethylpyrazole-4-carboxamide, N-[4-(1-azepanylsulfonyl)phenyl]-1,5-dimethyl-1H-pyrazole-4-carboxamide, N-[4-(azepan-1-ylsulfonyl)phenyl]-1,5-dimethyl-1H-pyrazole-4-carboxamide, N-[4-(azepan-1-ylsulfonyl)phenyl]-1,5-dimethyl-pyrazole-4-carboxamide
| Molecular Formula | C18H24N4O3S |
| Molecular Weight | 376.15692 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 92.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 376.15692 Da |
| Heavy Atoms | 26 |
| Complexity | 576.0 |
| SMILES | CC1=C(C=NN1C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3 |
| InChIKey | QONDCJCYRFTYOB-UHFFFAOYSA-N |
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[4-(azepan-1-ylsulfonyl)phenyl]-1,5-dimethylpyrazole-4-carboxamide. The TPSA of 92.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[4-(azepan-1-ylsulfonyl)phenyl]-1,5-dimethylpyrazole-4-carboxamide. Following Lipinski's Rule of Five, N-[4-(azepan-1-ylsulfonyl)phenyl]-1,5-dimethylpyrazole-4-carboxamide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-[4-(azepan-1-ylsulfonyl)phenyl]-1,5-dimethylpyrazole-4-carboxamide is 492423-00-4.
The molecular formula of N-[4-(azepan-1-ylsulfonyl)phenyl]-1,5-dimethylpyrazole-4-carboxamide is C18H24N4O3S.
The molecular weight of N-[4-(azepan-1-ylsulfonyl)phenyl]-1,5-dimethylpyrazole-4-carboxamide is 376.15692 g/mol.
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