Boc-(S)-alpha-(3-thiophenylmethyl)-proline
TL;DR: Boc-(S)-alpha-(3-thiophenylmethyl)-proline (CAS 1217714-91-4) is a chemical compound with molecular formula C15H21NO4S and molecular weight 311.11914 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]-2-(thiophen-3-ylmethyl)pyrrolidine-2-carboxylic acid
Also Known As: Boc-(S)-alpha-(3-thiophenylmethyl)-proline, Boc-(S)-a-(3-thiophenylmethyl)proline, 6225AH, (S)-1-(tert-Butoxycarbonyl)-2-(thiophen-3-ylmethyl)pyrrolidine-2-carboxylic acid, (2S)-1-tert-butoxycarbonyl-2-(3-thenyl)proline
Technical Specifications
| Molecular Formula | C15H21NO4S |
| Molecular Weight | 311.11914 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 95.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 311.11914 Da |
| Heavy Atoms | 21 |
| Complexity | 420.0 |
| SMILES | CC(C)(C)OC(=O)N1CCC[C@]1(CC2=CSC=C2)C(=O)O |
| InChIKey | LSZNTEAQCQFYGJ-HNNXBMFYSA-N |
Chemical Property Profile of Boc-(S)-alpha-(3-thiophenylmethyl)-proline
Property Insights of Boc-(S)-alpha-(3-thiophenylmethyl)-proline
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Boc-(S)-alpha-(3-thiophenylmethyl)-proline. The TPSA of 95.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Boc-(S)-alpha-(3-thiophenylmethyl)-proline. Following Lipinski's Rule of Five, Boc-(S)-alpha-(3-thiophenylmethyl)-proline has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Boc-(S)-alpha-(3-thiophenylmethyl)-proline?
The CAS number of Boc-(S)-alpha-(3-thiophenylmethyl)-proline is 1217714-91-4.
What is the molecular formula of Boc-(S)-alpha-(3-thiophenylmethyl)-proline?
The molecular formula of Boc-(S)-alpha-(3-thiophenylmethyl)-proline is C15H21NO4S.
What is the molecular weight of Boc-(S)-alpha-(3-thiophenylmethyl)-proline?
The molecular weight of Boc-(S)-alpha-(3-thiophenylmethyl)-proline is 311.11914 g/mol.
Where can I buy Boc-(S)-alpha-(3-thiophenylmethyl)-proline?
You can request a quote for Boc-(S)-alpha-(3-thiophenylmethyl)-proline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Boc-(S)-alpha-(3-thiophenylmethyl)-proline?
Yes, CoreyChem provides custom synthesis services for Boc-(S)-alpha-(3-thiophenylmethyl)-proline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.