![8-[(4-chloroanilino)diazenyl]-1,3-dimethyl-7H-purine-2,6-dione structure](/static/products/373/373612-16-9.png)
8-[(4-chloroanilino)diazenyl]-1,3-dimethyl-7H-purine-2,6-dione
TL;DR: 8-[(4-chloroanilino)diazenyl]-1,3-dimethyl-7H-purine-2,6-dione (CAS 373612-16-9) is a chemical compound with molecular formula C13H12ClN7O2 and molecular weight 333.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[(4-chloroanilino)diazenyl]-1,3-dimethyl-7H-purine-2,6-dione
| Molecular Formula | C13H12ClN7O2 |
|---|---|
| Molecular Weight | 333.07 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 106.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 333.0741 |
| Heavy Atoms | 23 |
| Complexity | 509.0 |
Chemical Identifiers
| CAS Number | 373612-16-9 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)NC(=N2)N=NNC3=CC=C(C=C3)Cl |
| InChIKey | BSXHYJWNSCNRMN-UHFFFAOYSA-N |
Product Overview
8-[(4-chloroanilino)diazenyl]-1,3-dimethyl-7H-purine-2,6-dione (CAS 373612-16-9), with molecular formula C13H12ClN7O2 and molecular weight 333.07 g/mol. IUPAC: 8-[(4-chloroanilino)diazenyl]-1,3-dimethyl-7H-purine-2,6-dione.
Chemical Property Profile of 8-[(4-chloroanilino)diazenyl]-1,3-dimethyl-7H-purine-2,6-dione
Property Insights of 8-[(4-chloroanilino)diazenyl]-1,3-dimethyl-7H-purine-2,6-dione
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-[(4-chloroanilino)diazenyl]-1,3-dimethyl-7H-purine-2,6-dione. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-[(4-chloroanilino)diazenyl]-1,3-dimethyl-7H-purine-2,6-dione. Following Lipinski's Rule of Five, 8-[(4-chloroanilino)diazenyl]-1,3-dimethyl-7H-purine-2,6-dione has 2 hydrogen bond donor(s) and 6 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 8-[(4-chloroanilino)diazenyl]-1,3-dimethyl-7H-purine-2,6-dione?
The CAS number of 8-[(4-chloroanilino)diazenyl]-1,3-dimethyl-7H-purine-2,6-dione is 373612-16-9.
What is the molecular formula of 8-[(4-chloroanilino)diazenyl]-1,3-dimethyl-7H-purine-2,6-dione?
The molecular formula of 8-[(4-chloroanilino)diazenyl]-1,3-dimethyl-7H-purine-2,6-dione is C13H12ClN7O2.
What is the molecular weight of 8-[(4-chloroanilino)diazenyl]-1,3-dimethyl-7H-purine-2,6-dione?
The molecular weight of 8-[(4-chloroanilino)diazenyl]-1,3-dimethyl-7H-purine-2,6-dione is 333.07 g/mol.
Where can I buy 8-[(4-chloroanilino)diazenyl]-1,3-dimethyl-7H-purine-2,6-dione?
You can request a quote for 8-[(4-chloroanilino)diazenyl]-1,3-dimethyl-7H-purine-2,6-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-[(4-chloroanilino)diazenyl]-1,3-dimethyl-7H-purine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 8-[(4-chloroanilino)diazenyl]-1,3-dimethyl-7H-purine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.