A2979/0125588
TL;DR: A2979/0125588 (CAS 575470-22-3) is a chemical compound with molecular formula C19H10ClF6N5O2 and molecular weight 489.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-7-pyridin-3-yl-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione
Also Known As: A2979/0125588, 1-(4-chlorophenyl)-7-(pyridin-3-yl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione, 1-(4-chlorophenyl)-4-hydroxy-7-(pyridin-3-yl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidin-2(1H)-one, 1-(4-chlorophenyl)-7-(3-pyridinyl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione, 1-(4-CHLOROPHENYL)-7-(PYRIDIN-3-YL)-5,5-BIS(TRIFLUOROMETHYL)-1H,2H,3H,4H,5H,8H-PYRIMIDO[4,5-D][1,3]DIAZINE-2,4-DIONE
| Molecular Formula | C19H10ClF6N5O2 |
|---|---|
| Molecular Weight | 489.04 g/mol |
| LogP | 3.7664 |
| Topological Polar Surface Area | 92.14 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 489.04272 |
| Heavy Atoms | 33 |
| Complexity | 1347.1414 |
Chemical Identifiers
| CAS Number | 575470-22-3 |
|---|---|
| SMILES | C1=CC(=CN=C1)C2=NC(C3=C(N2)N(C(=O)NC3=O)C4=CC=C(C=C4)Cl)(C(F)(F)F)C(F)(F)F |
Product Overview
A2979/0125588 (CAS 575470-22-3), with molecular formula C19H10ClF6N5O2 and molecular weight 489.04 g/mol. IUPAC: 1-(4-chlorophenyl)-7-pyridin-3-yl-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione.
Chemical Property Profile of A2979/0125588
Property Insights of A2979/0125588
The XLogP value of 3.7664 indicates that A2979/0125588 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.14 Ų falls within the moderate polarity range, balancing permeability and solubility for A2979/0125588. Following Lipinski's Rule of Five, A2979/0125588 has 2 hydrogen bond donor(s) and 5 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 A2979/0125588?
The CAS number of A2979/0125588 is 575470-22-3.
What is the molecular formula of A2979/0125588?
The molecular formula of A2979/0125588 is C19H10ClF6N5O2.
What is the molecular weight of A2979/0125588?
The molecular weight of A2979/0125588 is 489.04 g/mol.
Where can I buy A2979/0125588?
You can request a quote for A2979/0125588 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2979/0125588?
Yes, KEHONG BIO provides custom synthesis services for A2979/0125588 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.