PD 116152
TL;DR: PD 116152 (CAS 101708-64-9) is a chemical compound with molecular formula C16H12N2O6 and molecular weight 328.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 7-hydroxy-6-(hydroxymethylidene)-8-methyl-4,9-dioxo-10H-phenazine-1-carboxylate
Also Known As: methyl 7-hydroxy-6-(hydroxymethylidene)-8-methyl-4,9-dioxo-10H-phenazine-1-carboxylate, 1-Phenazinecarboxylic acid, 6-formyl-4,7,9-trihydroxy-8-methyl-, methyl ester, 6-Formyl-4,7,9-trihydroxy-8-methyl-1-phenazinecarboxylic acid, methyl ester, RefChem:928651
| Molecular Formula | C16H12N2O6 |
|---|---|
| Molecular Weight | 328.07 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 125.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 328.06955 |
| Heavy Atoms | 24 |
| Complexity | 896.0 |
Chemical Identifiers
| CAS Number | 101708-64-9 |
|---|---|
| SMILES | CC1=C(C(=CO)C2=C(C1=O)NC3=C(C=CC(=O)C3=N2)C(=O)OC)O |
| InChIKey | DPMHKBMRFUGOOD-UHFFFAOYSA-N |
Product Overview
PD 116152 (CAS 101708-64-9), with molecular formula C16H12N2O6 and molecular weight 328.07 g/mol. IUPAC: methyl 7-hydroxy-6-(hydroxymethylidene)-8-methyl-4,9-dioxo-10H-phenazine-1-carboxylate.
Chemical Property Profile of PD 116152
Property Insights of PD 116152
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for PD 116152. The TPSA of 125.0 Ų falls within the moderate polarity range, balancing permeability and solubility for PD 116152. Following Lipinski's Rule of Five, PD 116152 has 3 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 PD 116152?
The CAS number of PD 116152 is 101708-64-9.
What is the molecular formula of PD 116152?
The molecular formula of PD 116152 is C16H12N2O6.
What is the molecular weight of PD 116152?
The molecular weight of PD 116152 is 328.07 g/mol.
Where can I buy PD 116152?
You can request a quote for PD 116152 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for PD 116152?
Yes, KEHONG BIO provides custom synthesis services for PD 116152 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.