A3888/0165325
TL;DR: A3888/0165325 (CAS 728883-72-5) is a chemical compound with molecular formula C17H17N5O2 and molecular weight 323.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-(4-ethylphenyl)-7-methyl-2,3,5,7,13-pentazatricyclo[7.4.0.02,6]trideca-1(9),3,5-triene-8,12-dione
Also Known As: A3888/0165325, 6-(4-ethylphenyl)-4-methyl-6,9-dihydropyrido[3,2-e][1,2,4]triazolo[1,5-a]pyrimidine-5,8(4H,7H)-dione, 6-(4-ethylphenyl)-4-methyl-6,7-dihydropyrido[3,2-e][1,2,4]triazolo[1,5-a]pyrimidine-5,8(4H,9H)-dione
| Molecular Formula | C17H17N5O2 |
|---|---|
| Molecular Weight | 323.14 g/mol |
| LogP | 1.4645 |
| Topological Polar Surface Area | 81.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 323.1382 |
| Heavy Atoms | 24 |
| Complexity | 1000.2331 |
Chemical Identifiers
| CAS Number | 728883-72-5 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)C2CC(=O)NC3=C2C(=O)N(C4=NC=NN34)C |
Product Overview
A3888/0165325 (CAS 728883-72-5), with molecular formula C17H17N5O2 and molecular weight 323.14 g/mol. IUPAC: 10-(4-ethylphenyl)-7-methyl-2,3,5,7,13-pentazatricyclo[7.4.0.02,6]trideca-1(9),3,5-triene-8,12-dione.
Chemical Property Profile of A3888/0165325
Property Insights of A3888/0165325
The XLogP value of 1.4645 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A3888/0165325. The TPSA of 81.29 Ų falls within the moderate polarity range, balancing permeability and solubility for A3888/0165325. Following Lipinski's Rule of Five, A3888/0165325 has 1 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 A3888/0165325?
The CAS number of A3888/0165325 is 728883-72-5.
What is the molecular formula of A3888/0165325?
The molecular formula of A3888/0165325 is C17H17N5O2.
What is the molecular weight of A3888/0165325?
The molecular weight of A3888/0165325 is 323.14 g/mol.
Where can I buy A3888/0165325?
You can request a quote for A3888/0165325 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3888/0165325?
Yes, KEHONG BIO provides custom synthesis services for A3888/0165325 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.