C17H16N6O5
TL;DR: C17H16N6O5 (CAS 315218-06-5) is a chemical compound with molecular formula C17H16N6O5 and molecular weight 384.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(E)-[[2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetyl]hydrazinylidene]methyl]benzoic acid
Also Known As: (E)-4-((2-(2-(1,3-dimethyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)acetyl)hydrazono)methyl)benzoic acid, 4-[[[2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetyl]hydrazinylidene]methyl]benzoic Acid, 4-((E)-{[(1,3-DIMETHYL-2,6-DIOXO-1,2,3,6-TETRAHYDRO-7H-PURIN-7-YL)ACETYL]HYDRAZONO}METHYL)BENZOIC ACID, 4-{(1E)-2-[2-(1,3-dimethyl-2,6-dioxo(1,3,7-trihydropurin-7-yl))acetylamino]-2- azavinyl}benzoic acid
| Molecular Formula | C17H16N6O5 |
|---|---|
| Molecular Weight | 384.12 g/mol |
| LogP | -0.7178 |
| Topological Polar Surface Area | 140.58 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 384.11823 |
| Heavy Atoms | 28 |
| Complexity | 1215.7943 |
Chemical Identifiers
| CAS Number | 315218-06-5 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)N/N=C/C3=CC=C(C=C3)C(=O)O |
Product Overview
C17H16N6O5 (CAS 315218-06-5), with molecular formula C17H16N6O5 and molecular weight 384.12 g/mol. IUPAC: 4-[(E)-[[2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetyl]hydrazinylidene]methyl]benzoic acid.
Chemical Property Profile of C17H16N6O5
Property Insights of C17H16N6O5
The XLogP value of -0.7178 indicates that C17H16N6O5 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 140.58 Ų indicates high polarity, suggesting C17H16N6O5 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, C17H16N6O5 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 C17H16N6O5?
The CAS number of C17H16N6O5 is 315218-06-5.
What is the molecular formula of C17H16N6O5?
The molecular formula of C17H16N6O5 is C17H16N6O5.
What is the molecular weight of C17H16N6O5?
The molecular weight of C17H16N6O5 is 384.12 g/mol.
Where can I buy C17H16N6O5?
You can request a quote for C17H16N6O5 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C17H16N6O5?
Yes, KEHONG BIO provides custom synthesis services for C17H16N6O5 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.