TL;DR: 1-(4-Methylphenyl)sulfonylpyrrolidine-2-carboxamide (CAS 1008481-04-6) is a chemical compound with molecular formula C12H16N2O3S and molecular weight 268.08817 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxamide
Also Known As: 1-tosylpyrrolidine-2-carboxamide, 1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxamide, 1-[(4-methylphenyl)sulfonyl]prolinamide, BAS 06970642, 1-[(4-methylphenyl)sulfonyl]pyrrolidine-2-carboxamide
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C12H16N2O3S |
| Molecular Weight | 268.08817 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 88.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 268.08817 Da |
| Heavy Atoms | 18 |
| Complexity | 408.0 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)N |
| InChIKey | YDHWEEPSGQVJGO-UHFFFAOYSA-N |
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Methylphenyl)sulfonylpyrrolidine-2-carboxamide. The TPSA of 88.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Methylphenyl)sulfonylpyrrolidine-2-carboxamide. Following Lipinski's Rule of Five, 1-(4-Methylphenyl)sulfonylpyrrolidine-2-carboxamide 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 1-(4-Methylphenyl)sulfonylpyrrolidine-2-carboxamide is 1008481-04-6.
The molecular formula of 1-(4-Methylphenyl)sulfonylpyrrolidine-2-carboxamide is C12H16N2O3S.
The molecular weight of 1-(4-Methylphenyl)sulfonylpyrrolidine-2-carboxamide is 268.08817 g/mol.
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