4-氧代-7-氨磺酰基-1H-喹啉-3-甲酸
TL;DR: 4-氧代-7-氨磺酰基-1H-喹啉-3-甲酸 (CAS 63463-31-0) is a chemical compound with molecular formula C10H8N2O5S and molecular weight 268.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-氧代-7-氨磺酰基-1H-喹啉-3-甲酸
4-oxo-7-sulfamoyl-1H-quinoline-3-carboxylic acid
Also Known As: 4-Hydroxy-7-sulfamoylquinoline-3-carboxylic acid, 4-oxo-7-sulfamoyl-1H-quinoline-3-carboxylic acid, 3-Quinolinecarboxylicacid, 7-(aminosulfonyl)-4-hydroxy-, 3-Quinolinecarboxylicacid,7-(aminosulfonyl)-4-hydroxy, 3-Quinolinecarboxylic acid, 7-(aminosulfonyl)-4-hydroxy-
| Molecular Formula | C10H8N2O5S |
|---|---|
| Molecular Weight | 268.02 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 135.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 268.01538 |
| Heavy Atoms | 18 |
| Complexity | 519.0 |
Chemical Identifiers
| CAS Number | 63463-31-0 |
|---|---|
| SMILES | C1=CC2=C(C=C1S(=O)(=O)N)NC=C(C2=O)C(=O)O |
| InChIKey | JOIHURFQPHXDFA-UHFFFAOYSA-N |
Product Overview
4-氧代-7-氨磺酰基-1H-喹啉-3-甲酸 (CAS 63463-31-0), with molecular formula C10H8N2O5S and molecular weight 268.02 g/mol. IUPAC: 4-oxo-7-sulfamoyl-1H-quinoline-3-carboxylic acid.
Chemical Property Profile of 4-氧代-7-氨磺酰基-1H-喹啉-3-甲酸
Property Insights of 4-氧代-7-氨磺酰基-1H-喹啉-3-甲酸
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-氧代-7-氨磺酰基-1H-喹啉-3-甲酸. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-氧代-7-氨磺酰基-1H-喹啉-3-甲酸. Following Lipinski's Rule of Five, 4-氧代-7-氨磺酰基-1H-喹啉-3-甲酸 has 3 hydrogen bond donor(s) and 7 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 4-氧代-7-氨磺酰基-1H-喹啉-3-甲酸?
The CAS number of 4-氧代-7-氨磺酰基-1H-喹啉-3-甲酸 is 63463-31-0.
What is the molecular formula of 4-氧代-7-氨磺酰基-1H-喹啉-3-甲酸?
The molecular formula of 4-氧代-7-氨磺酰基-1H-喹啉-3-甲酸 is C10H8N2O5S.
What is the molecular weight of 4-氧代-7-氨磺酰基-1H-喹啉-3-甲酸?
The molecular weight of 4-氧代-7-氨磺酰基-1H-喹啉-3-甲酸 is 268.02 g/mol.
Where can I buy 4-氧代-7-氨磺酰基-1H-喹啉-3-甲酸?
You can request a quote for 4-氧代-7-氨磺酰基-1H-喹啉-3-甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-氧代-7-氨磺酰基-1H-喹啉-3-甲酸?
Yes, KEHONG BIO provides custom synthesis services for 4-氧代-7-氨磺酰基-1H-喹啉-3-甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.