AB00671174-01
TL;DR: AB00671174-01 (CAS 847190-81-2) is a chemical compound with molecular formula C19H21N5O4S and molecular weight 415.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(furan-2-yl)-1,3-dimethyl-5-(2-oxo-2-piperidin-1-ylethyl)sulfanylpyrimido[4,5-d]pyrimidine-2,4-dione
Also Known As: AB00671174-01, F0654-1303, 7-(furan-2-yl)-1,3-dimethyl-5-((2-oxo-2-(piperidin-1-yl)ethyl)thio)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione, 7-(furan-2-yl)-1,3-dimethyl-5-(2-oxo-2-piperidin-1-ylethyl)sulfanylpyrimido[4,5-d]pyrimidine-2,4-dione, 7-(furan-2-yl)-1,3-dimethyl-5-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-1H,2H,3H,4H-[1,3]diazino[4,5-d]pyrimidine-2,4-dione
| Molecular Formula | C19H21N5O4S |
|---|---|
| Molecular Weight | 415.13 g/mol |
| LogP | 1.3918 |
| Topological Polar Surface Area | 103.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 415.13144 |
| Heavy Atoms | 29 |
| Complexity | 1176.0082 |
Chemical Identifiers
| CAS Number | 847190-81-2 |
|---|---|
| SMILES | CN1C2=C(C(=NC(=N2)C3=CC=CO3)SCC(=O)N4CCCCC4)C(=O)N(C1=O)C |
Product Overview
AB00671174-01 (CAS 847190-81-2), with molecular formula C19H21N5O4S and molecular weight 415.13 g/mol. IUPAC: 7-(furan-2-yl)-1,3-dimethyl-5-(2-oxo-2-piperidin-1-ylethyl)sulfanylpyrimido[4,5-d]pyrimidine-2,4-dione.
Chemical Property Profile of AB00671174-01
Property Insights of AB00671174-01
The XLogP value of 1.3918 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00671174-01. The TPSA of 103.23 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00671174-01. Following Lipinski's Rule of Five, AB00671174-01 has 0 hydrogen bond donor(s) and 7 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 AB00671174-01?
The CAS number of AB00671174-01 is 847190-81-2.
What is the molecular formula of AB00671174-01?
The molecular formula of AB00671174-01 is C19H21N5O4S.
What is the molecular weight of AB00671174-01?
The molecular weight of AB00671174-01 is 415.13 g/mol.
Where can I buy AB00671174-01?
You can request a quote for AB00671174-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00671174-01?
Yes, KEHONG BIO provides custom synthesis services for AB00671174-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.