TL;DR: 3-(Phenylsulfonyl)pyrrolidine (CAS 1003562-01-3) is a chemical compound with molecular formula C10H13NO2S and molecular weight 211.0667 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(benzenesulfonyl)pyrrolidine
Also Known As: 3-(PHENYLSULFONYL)PYRROLIDINE, 3-(benzenesulfonyl)pyrrolidine, 3-Benzenesulfonyl-pyrrolidine, 3-phenylsulfonylpyrrolidine, PYRROLIDINE, 3-(PHENYLSULFONYL)-
| Molecular Formula | C10H13NO2S |
| Molecular Weight | 211.0667 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 54.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 211.0667 Da |
| Heavy Atoms | 14 |
| Complexity | 275.0 |
| SMILES | C1CNCC1S(=O)(=O)C2=CC=CC=C2 |
| InChIKey | LHGKEGUGTRSIKW-UHFFFAOYSA-N |
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Phenylsulfonyl)pyrrolidine. With a topological polar surface area (TPSA) of 54.6 Ų, 3-(Phenylsulfonyl)pyrrolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Phenylsulfonyl)pyrrolidine has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-(Phenylsulfonyl)pyrrolidine is 1003562-01-3.
The molecular formula of 3-(Phenylsulfonyl)pyrrolidine is C10H13NO2S.
The molecular weight of 3-(Phenylsulfonyl)pyrrolidine is 211.0667 g/mol.
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