N-(3,5-二氯苯基)-3-羟基琥珀酰胺酸
TL;DR: N-(3,5-二氯苯基)-3-羟基琥珀酰胺酸 (CAS 126441-08-5) is a chemical compound with molecular formula C10H9Cl2NO4 and molecular weight 276.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3,5-二氯苯基)-3-羟基琥珀酰胺酸
4-(3,5-dichloroanilino)-3-hydroxy-4-oxobutanoic acid
Also Known As: 3-NDHSA, N-(3,5-Dichlorophenyl)-3-hydroxysuccinamic acid, Sid 755266, 4-(3,5-dichloroanilino)-3-hydroxy-4-oxobutanoic acid, 3-(3,5-Dichlorophenyl)carbamoyl-3-hydroxypropanoic acid
| Molecular Formula | C10H9Cl2NO4 |
|---|---|
| Molecular Weight | 276.99 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 86.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 276.99088 |
| Heavy Atoms | 17 |
| Complexity | 290.0 |
Chemical Identifiers
| CAS Number | 126441-08-5 |
|---|---|
| SMILES | C1=C(C=C(C=C1Cl)Cl)NC(=O)C(CC(=O)O)O |
| InChIKey | OQKMKAOUMDBGRM-UHFFFAOYSA-N |
Product Overview
N-(3,5-二氯苯基)-3-羟基琥珀酰胺酸 (CAS 126441-08-5), with molecular formula C10H9Cl2NO4 and molecular weight 276.99 g/mol. IUPAC: 4-(3,5-dichloroanilino)-3-hydroxy-4-oxobutanoic acid.
Chemical Property Profile of N-(3,5-二氯苯基)-3-羟基琥珀酰胺酸
Property Insights of N-(3,5-二氯苯基)-3-羟基琥珀酰胺酸
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3,5-二氯苯基)-3-羟基琥珀酰胺酸. The TPSA of 86.6 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3,5-二氯苯基)-3-羟基琥珀酰胺酸. Following Lipinski's Rule of Five, N-(3,5-二氯苯基)-3-羟基琥珀酰胺酸 has 3 hydrogen bond donor(s) and 4 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 N-(3,5-二氯苯基)-3-羟基琥珀酰胺酸?
The CAS number of N-(3,5-二氯苯基)-3-羟基琥珀酰胺酸 is 126441-08-5.
What is the molecular formula of N-(3,5-二氯苯基)-3-羟基琥珀酰胺酸?
The molecular formula of N-(3,5-二氯苯基)-3-羟基琥珀酰胺酸 is C10H9Cl2NO4.
What is the molecular weight of N-(3,5-二氯苯基)-3-羟基琥珀酰胺酸?
The molecular weight of N-(3,5-二氯苯基)-3-羟基琥珀酰胺酸 is 276.99 g/mol.
Where can I buy N-(3,5-二氯苯基)-3-羟基琥珀酰胺酸?
You can request a quote for N-(3,5-二氯苯基)-3-羟基琥珀酰胺酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3,5-二氯苯基)-3-羟基琥珀酰胺酸?
Yes, KEHONG BIO provides custom synthesis services for N-(3,5-二氯苯基)-3-羟基琥珀酰胺酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.