AN-698/41741796
TL;DR: AN-698/41741796 (CAS 665015-91-8) is a chemical compound with molecular formula C23H26FN3O2S2 and molecular weight 459.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]sulfanyl-3-(4-fluorophenyl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-one
Also Known As: AN-698/41741796, 2-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]sulfanyl-3-(4-fluorophenyl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-one, 2-{[2-(2,6-dimethyl-1-piperidinyl)-2-oxoethyl]sulfanyl}-3-(4-fluorophenyl)-5,6-dimethylthieno[2,3-d]pyrimidin-4(3H)-one
| Molecular Formula | C23H26FN3O2S2 |
|---|---|
| Molecular Weight | 459.15 g/mol |
| LogP | 5.08474 |
| Topological Polar Surface Area | 55.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 459.14505 |
| Heavy Atoms | 31 |
| Complexity | 1176.2351 |
Chemical Identifiers
| CAS Number | 665015-91-8 |
|---|---|
| SMILES | CC1CCCC(N1C(=O)CSC2=NC3=C(C(=C(S3)C)C)C(=O)N2C4=CC=C(C=C4)F)C |
Product Overview
AN-698/41741796 (CAS 665015-91-8), with molecular formula C23H26FN3O2S2 and molecular weight 459.15 g/mol. IUPAC: 2-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]sulfanyl-3-(4-fluorophenyl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-one.
Chemical Property Profile of AN-698/41741796
Property Insights of AN-698/41741796
The XLogP value of 5.08474 indicates that AN-698/41741796 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.2 Ų, AN-698/41741796 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AN-698/41741796 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AN-698/41741796?
The CAS number of AN-698/41741796 is 665015-91-8.
What is the molecular formula of AN-698/41741796?
The molecular formula of AN-698/41741796 is C23H26FN3O2S2.
What is the molecular weight of AN-698/41741796?
The molecular weight of AN-698/41741796 is 459.15 g/mol.
Where can I buy AN-698/41741796?
You can request a quote for AN-698/41741796 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-698/41741796?
Yes, KEHONG BIO provides custom synthesis services for AN-698/41741796 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.