TL;DR: N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]naphthalene-2-sulfonamide (CAS 1005681-83-3) is a chemical compound with molecular formula C22H21N3O2S and molecular weight 391.13544 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]naphthalene-2-sulfonamide
Also Known As: N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]naphthalene-2-sulfonamide, N-[(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methyl]naphthalene-2-sulfonamide, N~2~-[(3,5-DIMETHYL-1-PHENYL-1H-PYRAZOL-4-YL)METHYL]-2-NAPHTHALENESULFONAMIDE
| Molecular Formula | C22H21N3O2S |
| Molecular Weight | 391.13544 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 72.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 391.13544 Da |
| Heavy Atoms | 28 |
| Complexity | 614.0 |
| SMILES | CC1=C(C(=NN1C2=CC=CC=C2)C)CNS(=O)(=O)C3=CC4=CC=CC=C4C=C3 |
| InChIKey | BVYCJTXVXXEARX-UHFFFAOYSA-N |
The XLogP value of 4.4 indicates that N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]naphthalene-2-sulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]naphthalene-2-sulfonamide. Following Lipinski's Rule of Five, N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]naphthalene-2-sulfonamide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]naphthalene-2-sulfonamide is 1005681-83-3.
The molecular formula of N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]naphthalene-2-sulfonamide is C22H21N3O2S.
The molecular weight of N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]naphthalene-2-sulfonamide is 391.13544 g/mol.
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