ChemDiv1_022596
TL;DR: ChemDiv1_022596 (CAS 24680-25-9) is a chemical compound with molecular formula C21H15N3O3 and molecular weight 357.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methyl-2-phenyl-5,7,9-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1(10),3(8),11,13,15-pentaene-4,6,17-trione
Also Known As: ChemDiv1_022596, DivK1c_003860, CDS1_002820, BAS 01520459, BIM-0040904.P001
| Molecular Formula | C21H15N3O3 |
|---|---|
| Molecular Weight | 357.11 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 78.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 357.11133 |
| Heavy Atoms | 27 |
| Complexity | 790.0 |
Chemical Identifiers
| CAS Number | 24680-25-9 |
|---|---|
| SMILES | CN1C2=C(C(C3=C(N2)C4=CC=CC=C4C3=O)C5=CC=CC=C5)C(=O)NC1=O |
| InChIKey | BPBFYBNRQMSJHB-UHFFFAOYSA-N |
Product Overview
ChemDiv1_022596 (CAS 24680-25-9), with molecular formula C21H15N3O3 and molecular weight 357.11 g/mol. IUPAC: 7-methyl-2-phenyl-5,7,9-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1(10),3(8),11,13,15-pentaene-4,6,17-trione.
Chemical Property Profile of ChemDiv1_022596
Property Insights of ChemDiv1_022596
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv1_022596. The TPSA of 78.5 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_022596. Following Lipinski's Rule of Five, ChemDiv1_022596 has 2 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 ChemDiv1_022596?
The CAS number of ChemDiv1_022596 is 24680-25-9.
What is the molecular formula of ChemDiv1_022596?
The molecular formula of ChemDiv1_022596 is C21H15N3O3.
What is the molecular weight of ChemDiv1_022596?
The molecular weight of ChemDiv1_022596 is 357.11 g/mol.
Where can I buy ChemDiv1_022596?
You can request a quote for ChemDiv1_022596 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_022596?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_022596 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.