AB00674770-01
TL;DR: AB00674770-01 (CAS 866340-77-4) is a chemical compound with molecular formula C22H20N2O4S and molecular weight 408.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[2-(4-methoxyphenyl)-7-methyl-5H-chromeno[2,3-d]pyrimidin-4-yl]sulfanyl]acetate
Also Known As: AB00674770-01, F1602-0192, METHYL 2-{[2-(4-METHOXYPHENYL)-7-METHYL-5H-CHROMENO[2,3-D]PYRIMIDIN-4-YL]SULFANYL}ACETATE, methyl 2-[[2-(4-methoxyphenyl)-7-methyl-5H-chromeno[2,3-d]pyrimidin-4-yl]sulfanyl]acetate, methyl {[2-(4-methoxyphenyl)-7-methyl-5H-chromeno[2,3-d]pyrimidin-4-yl]thio}acetate
| Molecular Formula | C22H20N2O4S |
|---|---|
| Molecular Weight | 408.11 g/mol |
| LogP | 4.42222 |
| Topological Polar Surface Area | 70.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 408.11438 |
| Heavy Atoms | 29 |
| Complexity | 1067.1526 |
Chemical Identifiers
| CAS Number | 866340-77-4 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)OC3=C(C2)C(=NC(=N3)C4=CC=C(C=C4)OC)SCC(=O)OC |
Product Overview
AB00674770-01 (CAS 866340-77-4), with molecular formula C22H20N2O4S and molecular weight 408.11 g/mol. IUPAC: methyl 2-[[2-(4-methoxyphenyl)-7-methyl-5H-chromeno[2,3-d]pyrimidin-4-yl]sulfanyl]acetate.
Chemical Property Profile of AB00674770-01
Property Insights of AB00674770-01
The XLogP value of 4.42222 indicates that AB00674770-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.54 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00674770-01. Following Lipinski's Rule of Five, AB00674770-01 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 AB00674770-01?
The CAS number of AB00674770-01 is 866340-77-4.
What is the molecular formula of AB00674770-01?
The molecular formula of AB00674770-01 is C22H20N2O4S.
What is the molecular weight of AB00674770-01?
The molecular weight of AB00674770-01 is 408.11 g/mol.
Where can I buy AB00674770-01?
You can request a quote for AB00674770-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00674770-01?
Yes, KEHONG BIO provides custom synthesis services for AB00674770-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.