A3634/0154192
TL;DR: A3634/0154192 (CAS 697239-62-6) is a chemical compound with molecular formula C21H20ClFN6O3S and molecular weight 490.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[(3-chloro-4-fluorophenyl)carbamothioyl]piperazin-1-yl]-8-ethyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxylic acid
Also Known As: A3634/0154192, 2-[4-[(3-chloro-4-fluorophenyl)carbamothioyl]piperazin-1-yl]-8-ethyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxylic acid, 2-(4-((3-chloro-4-fluorophenyl)carbamothioyl)piperazin-1-yl)-8-ethyl-5-oxo-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylic acid, 2-{4-[(3-CHLORO-4-FLUOROANILINO)CARBOTHIOYL]PIPERAZINO}-8-ETHYL-5-OXO-5,8-DIHYDROPYRIDO[2,3-D]PYRIMIDINE-6-CARBOXYLIC ACID, 2-{4-[(3-chloro-4-fluorophenyl)carbamothioyl]piperazin-1-yl}-8-ethyl-5-oxo-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylic acid
| Molecular Formula | C21H20ClFN6O3S |
|---|---|
| Molecular Weight | 490.10 g/mol |
| LogP | 2.8211 |
| Topological Polar Surface Area | 103.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 490.09903 |
| Heavy Atoms | 33 |
| Complexity | 1309.135 |
Chemical Identifiers
| CAS Number | 697239-62-6 |
|---|---|
| SMILES | CCN1C=C(C(=O)C2=CN=C(N=C21)N3CCN(CC3)C(=S)NC4=CC(=C(C=C4)F)Cl)C(=O)O |
Product Overview
A3634/0154192 (CAS 697239-62-6), with molecular formula C21H20ClFN6O3S and molecular weight 490.10 g/mol. IUPAC: 2-[4-[(3-chloro-4-fluorophenyl)carbamothioyl]piperazin-1-yl]-8-ethyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxylic acid.
Chemical Property Profile of A3634/0154192
Property Insights of A3634/0154192
The XLogP value of 2.8211 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A3634/0154192. The TPSA of 103.59 Ų falls within the moderate polarity range, balancing permeability and solubility for A3634/0154192. Following Lipinski's Rule of Five, A3634/0154192 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 A3634/0154192?
The CAS number of A3634/0154192 is 697239-62-6.
What is the molecular formula of A3634/0154192?
The molecular formula of A3634/0154192 is C21H20ClFN6O3S.
What is the molecular weight of A3634/0154192?
The molecular weight of A3634/0154192 is 490.10 g/mol.
Where can I buy A3634/0154192?
You can request a quote for A3634/0154192 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3634/0154192?
Yes, KEHONG BIO provides custom synthesis services for A3634/0154192 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.