AS-871/41400081
TL;DR: AS-871/41400081 (CAS 618383-72-5) is a chemical compound with molecular formula C25H27N5O4 and molecular weight 461.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[2-(2-hydroxyethoxy)ethyl]-6-imino-11-methyl-2-oxo-N-(2-phenylethyl)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide
Also Known As: AS-871/41400081, 1-(2-(2-Hydroxyethoxy)ethyl)-2-imino-10-methyl-5-oxo-N-phenethyl-2,5-dihydro-1H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide, 1-[2-(2-hydroxyethoxy)ethyl]-2-imino-10-methyl-5-oxo-N-(2-phenylethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide, 1-[2-(2-hydroxyethoxy)ethyl]-2-imino-10-methyl-5-oxo-N-(2-phenylethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide, 1-(2-(2-Hydroxyethoxy)ethyl)-2-imino-10-methyl-5-oxo-N-(2-phenylethyl)-1,5-dihydro-2H-dipyrido(1,2-A:2,3-D)pyrimidine-3-carboxamide
| Molecular Formula | C25H27N5O4 |
|---|---|
| Molecular Weight | 461.21 g/mol |
| LogP | 1.41849 |
| Topological Polar Surface Area | 121.71 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 461.2063 |
| Heavy Atoms | 34 |
| Complexity | 1443.4271 |
Chemical Identifiers
| CAS Number | 618383-72-5 |
|---|---|
| SMILES | CC1=CC=CN2C1=NC3=C(C2=O)C=C(C(=N)N3CCOCCO)C(=O)NCCC4=CC=CC=C4 |
Product Overview
AS-871/41400081 (CAS 618383-72-5), with molecular formula C25H27N5O4 and molecular weight 461.21 g/mol. IUPAC: 7-[2-(2-hydroxyethoxy)ethyl]-6-imino-11-methyl-2-oxo-N-(2-phenylethyl)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide.
Chemical Property Profile of AS-871/41400081
Property Insights of AS-871/41400081
The XLogP value of 1.41849 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AS-871/41400081. The TPSA of 121.71 Ų falls within the moderate polarity range, balancing permeability and solubility for AS-871/41400081. Following Lipinski's Rule of Five, AS-871/41400081 has 3 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 AS-871/41400081?
The CAS number of AS-871/41400081 is 618383-72-5.
What is the molecular formula of AS-871/41400081?
The molecular formula of AS-871/41400081 is C25H27N5O4.
What is the molecular weight of AS-871/41400081?
The molecular weight of AS-871/41400081 is 461.21 g/mol.
Where can I buy AS-871/41400081?
You can request a quote for AS-871/41400081 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AS-871/41400081?
Yes, KEHONG BIO provides custom synthesis services for AS-871/41400081 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.