ChemDiv1_023377
TL;DR: ChemDiv1_023377 (CAS 332861-05-9) is a chemical compound with molecular formula C23H19N3O5 and molecular weight 417.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,5-dimethoxyphenyl)-7-methyl-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_023377, BAS 01849472, 5-(2,5-dimethoxyphenyl)-1-methyl-5,11-dihydro-1H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidine-2,4,6(3H)-trione, 5-(2,5-dimethoxyphenyl)-1-methyl-1H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidine-2,4,6(3H,5H,11H)-trione, 2-(2,5-dimethoxyphenyl)-7-methyl-5,7,9-triazatetracyclo[8.7.0.0^{3,8}.0^{11,16}]heptadeca-1(10),3(8),11(16),12,14-pentaene-4,6,17-trione
| Molecular Formula | C23H19N3O5 |
|---|---|
| Molecular Weight | 417.13 g/mol |
| LogP | 2.2558 |
| Topological Polar Surface Area | 102.42 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 417.13248 |
| Heavy Atoms | 31 |
| Complexity | 1413.4398 |
Chemical Identifiers
| CAS Number | 332861-05-9 |
|---|---|
| SMILES | CN1C2=C(C(C3=C(N2)C4=CC=CC=C4C3=O)C5=C(C=CC(=C5)OC)OC)C(=O)NC1=O |
Product Overview
ChemDiv1_023377 (CAS 332861-05-9), with molecular formula C23H19N3O5 and molecular weight 417.13 g/mol. IUPAC: 2-(2,5-dimethoxyphenyl)-7-methyl-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_023377
Property Insights of ChemDiv1_023377
The XLogP value of 2.2558 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv1_023377. The TPSA of 102.42 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_023377. Following Lipinski's Rule of Five, ChemDiv1_023377 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 ChemDiv1_023377?
The CAS number of ChemDiv1_023377 is 332861-05-9.
What is the molecular formula of ChemDiv1_023377?
The molecular formula of ChemDiv1_023377 is C23H19N3O5.
What is the molecular weight of ChemDiv1_023377?
The molecular weight of ChemDiv1_023377 is 417.13 g/mol.
Where can I buy ChemDiv1_023377?
You can request a quote for ChemDiv1_023377 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_023377?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_023377 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.