![1-[(5-Carboxy-2-chlorophenyl)sulfonyl]proline structure](/static/products/1008/1008580-51-5.webp)
1-[(5-Carboxy-2-chlorophenyl)sulfonyl]proline
TL;DR: 1-[(5-Carboxy-2-chlorophenyl)sulfonyl]proline (CAS 1008580-51-5) is a chemical compound with molecular formula C12H12ClNO6S and molecular weight 333.0074 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(5-carboxy-2-chlorophenyl)sulfonylpyrrolidine-2-carboxylic acid
Also Known As: CBKinase1_002977, CBKinase1_015377, 1-[(5-carboxy-2-chlorophenyl)sulfonyl]proline, VU0513056-1, F3195-0090
Technical Specifications
| Molecular Formula | C12H12ClNO6S |
| Molecular Weight | 333.0074 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 120.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 333.0074 Da |
| Heavy Atoms | 21 |
| Complexity | 530.0 |
| SMILES | C1CC(N(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)O)Cl)C(=O)O |
| InChIKey | ZPHDYKOOUAMDKQ-UHFFFAOYSA-N |
Chemical Property Profile of 1-[(5-Carboxy-2-chlorophenyl)sulfonyl]proline
Property Insights of 1-[(5-Carboxy-2-chlorophenyl)sulfonyl]proline
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(5-Carboxy-2-chlorophenyl)sulfonyl]proline. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(5-Carboxy-2-chlorophenyl)sulfonyl]proline. Following Lipinski's Rule of Five, 1-[(5-Carboxy-2-chlorophenyl)sulfonyl]proline has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-[(5-Carboxy-2-chlorophenyl)sulfonyl]proline?
The CAS number of 1-[(5-Carboxy-2-chlorophenyl)sulfonyl]proline is 1008580-51-5.
What is the molecular formula of 1-[(5-Carboxy-2-chlorophenyl)sulfonyl]proline?
The molecular formula of 1-[(5-Carboxy-2-chlorophenyl)sulfonyl]proline is C12H12ClNO6S.
What is the molecular weight of 1-[(5-Carboxy-2-chlorophenyl)sulfonyl]proline?
The molecular weight of 1-[(5-Carboxy-2-chlorophenyl)sulfonyl]proline is 333.0074 g/mol.
Where can I buy 1-[(5-Carboxy-2-chlorophenyl)sulfonyl]proline?
You can request a quote for 1-[(5-Carboxy-2-chlorophenyl)sulfonyl]proline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-[(5-Carboxy-2-chlorophenyl)sulfonyl]proline?
Yes, CoreyChem provides custom synthesis services for 1-[(5-Carboxy-2-chlorophenyl)sulfonyl]proline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.