1-(Benzylsulfonyl)-4-hydroxyproline
TL;DR: 1-(Benzylsulfonyl)-4-hydroxyproline (CAS 7469-25-2) is a chemical compound with molecular formula C12H15NO5S and molecular weight 285.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzylsulfonyl-4-hydroxypyrrolidine-2-carboxylic acid
Also Known As: 1-(Benzylsulfonyl)-4-hydroxyproline, 4-Hydroxy-1-(phenylmethanesulfonyl)proline, 1-benzylsulfonyl-4-hydroxypyrrolidine-2-carboxylic acid, trans-4-hydroxy-1-phenylmethanesulfonyl-L-proline, 1-benzylsulfonyl-4-hydroxy-pyrrolidine-2-carboxylic acid
| Molecular Formula | C12H15NO5S |
|---|---|
| Molecular Weight | 285.07 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 285.0671 |
| Heavy Atoms | 19 |
| Complexity | 424.0 |
Chemical Identifiers
| CAS Number | 7469-25-2 |
|---|---|
| SMILES | C1C(CN(C1C(=O)O)S(=O)(=O)CC2=CC=CC=C2)O |
| InChIKey | PXCAXESHASVBCJ-UHFFFAOYSA-N |
Product Overview
1-(Benzylsulfonyl)-4-hydroxyproline (CAS 7469-25-2), with molecular formula C12H15NO5S and molecular weight 285.07 g/mol. IUPAC: 1-benzylsulfonyl-4-hydroxypyrrolidine-2-carboxylic acid.
Chemical Property Profile of 1-(Benzylsulfonyl)-4-hydroxyproline
Property Insights of 1-(Benzylsulfonyl)-4-hydroxyproline
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Benzylsulfonyl)-4-hydroxyproline. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(Benzylsulfonyl)-4-hydroxyproline. Following Lipinski's Rule of Five, 1-(Benzylsulfonyl)-4-hydroxyproline has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(Benzylsulfonyl)-4-hydroxyproline?
The CAS number of 1-(Benzylsulfonyl)-4-hydroxyproline is 7469-25-2.
What is the molecular formula of 1-(Benzylsulfonyl)-4-hydroxyproline?
The molecular formula of 1-(Benzylsulfonyl)-4-hydroxyproline is C12H15NO5S.
What is the molecular weight of 1-(Benzylsulfonyl)-4-hydroxyproline?
The molecular weight of 1-(Benzylsulfonyl)-4-hydroxyproline is 285.07 g/mol.
Where can I buy 1-(Benzylsulfonyl)-4-hydroxyproline?
You can request a quote for 1-(Benzylsulfonyl)-4-hydroxyproline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Benzylsulfonyl)-4-hydroxyproline?
Yes, KEHONG BIO provides custom synthesis services for 1-(Benzylsulfonyl)-4-hydroxyproline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.