A2878/0121296
TL;DR: A2878/0121296 (CAS 497941-29-4) is a chemical compound with molecular formula C23H24N6O5S and molecular weight 496.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-ethyl-2-[4-[(4-methoxycarbonylphenyl)carbamothioyl]piperazin-1-yl]-5-oxopyrido[2,3-d]pyrimidine-6-carboxylic acid
Also Known As: A2878/0121296, 8-ethyl-2-(4-((4-(methoxycarbonyl)phenyl)carbamothioyl)piperazin-1-yl)-5-oxo-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylic acid, 8-ethyl-2-(4-{[4-(methoxycarbonyl)phenyl]carbamothioyl}piperazin-1-yl)-5-oxo-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylic acid, 8-ETHYL-2-(4-{[4-(METHOXYCARBONYL)PHENYL]CARBAMOTHIOYL}PIPERAZIN-1-YL)-5-OXO-5H,8H-PYRIDO[2,3-D]PYRIMIDINE-6-CARBOXYLIC ACID, 8-ethyl-2-[4-[(4-methoxycarbonylphenyl)carbamothioyl]piperazin-1-yl]-5-oxopyrido[2,3-d]pyrimidine-6-carboxylic acid
| Molecular Formula | C23H24N6O5S |
|---|---|
| Molecular Weight | 496.15 g/mol |
| LogP | 1.8152 |
| Topological Polar Surface Area | 129.89 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 496.1529 |
| Heavy Atoms | 35 |
| Complexity | 1349.0044 |
Chemical Identifiers
| CAS Number | 497941-29-4 |
|---|---|
| SMILES | CCN1C=C(C(=O)C2=CN=C(N=C21)N3CCN(CC3)C(=S)NC4=CC=C(C=C4)C(=O)OC)C(=O)O |
Product Overview
A2878/0121296 (CAS 497941-29-4), with molecular formula C23H24N6O5S and molecular weight 496.15 g/mol. IUPAC: 8-ethyl-2-[4-[(4-methoxycarbonylphenyl)carbamothioyl]piperazin-1-yl]-5-oxopyrido[2,3-d]pyrimidine-6-carboxylic acid.
Chemical Property Profile of A2878/0121296
Property Insights of A2878/0121296
The XLogP value of 1.8152 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A2878/0121296. The TPSA of 129.89 Ų falls within the moderate polarity range, balancing permeability and solubility for A2878/0121296. Following Lipinski's Rule of Five, A2878/0121296 has 2 hydrogen bond donor(s) and 8 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 A2878/0121296?
The CAS number of A2878/0121296 is 497941-29-4.
What is the molecular formula of A2878/0121296?
The molecular formula of A2878/0121296 is C23H24N6O5S.
What is the molecular weight of A2878/0121296?
The molecular weight of A2878/0121296 is 496.15 g/mol.
Where can I buy A2878/0121296?
You can request a quote for A2878/0121296 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2878/0121296?
Yes, KEHONG BIO provides custom synthesis services for A2878/0121296 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.