吡哌酸
TL;DR: 吡哌酸 (CAS 51940-44-4) is a chemical compound with molecular formula C14H17N5O3 and molecular weight 303.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
吡哌酸
8-ethyl-5-oxo-2-piperazin-1-ylpyrido[2,3-d]pyrimidine-6-carboxylic acid
Also Known As: pipemidic acid, Pipedac, Pipemid, Deblaston, Acido pipemidico
| Molecular Formula | C14H17N5O3 |
|---|---|
| Molecular Weight | 303.13 g/mol |
| LogP | -2.1 |
| Topological Polar Surface Area | 98.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 303.13315 |
| Heavy Atoms | 22 |
| Complexity | 489.0 |
| Melting Point | 253 - 255 °C |
| Solubility | 0.322 mg/mL at 25 °C |
Chemical Identifiers
| CAS Number | 51940-44-4 |
|---|---|
| SMILES | CCN1C=C(C(=O)C2=CN=C(N=C21)N3CCNCC3)C(=O)O |
| InChIKey | JOHZPMXAZQZXHR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
吡哌酸 (CAS 51940-44-4), with molecular formula C14H17N5O3 and molecular weight 303.13 g/mol. IUPAC: 8-ethyl-5-oxo-2-piperazin-1-ylpyrido[2,3-d]pyrimidine-6-carboxylic acid.
Chemical Property Profile of 吡哌酸
Property Insights of 吡哌酸
The XLogP value of -2.1 indicates that 吡哌酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 98.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 吡哌酸. Following Lipinski's Rule of Five, 吡哌酸 has 2 hydrogen bond donor(s) and 8 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 吡哌酸?
The CAS number of 吡哌酸 is 51940-44-4.
What is the molecular formula of 吡哌酸?
The molecular formula of 吡哌酸 is C14H17N5O3.
What is the molecular weight of 吡哌酸?
The molecular weight of 吡哌酸 is 303.13 g/mol.
Where can I buy 吡哌酸?
You can request a quote for 吡哌酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 吡哌酸?
Yes, KEHONG BIO provides custom synthesis services for 吡哌酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.