AF-399/40634492
TL;DR: AF-399/40634492 (CAS 315684-23-2) is a chemical compound with molecular formula C18H14ClN3OS2 and molecular weight 387.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylmethyl]-3,5-dimethyl-1,2-oxazole
Also Known As: AF-399/40634492, 4-({[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl}methyl)-3,5-dimethyl-1,2-oxazole, 4-[(3,5-dimethylisoxazol-4-yl)methylthio]-5-(4-chlorophenyl)thiopheno[2,3-d]py rimidine, 5-(4-chlorophenyl)-4-{[(3,5-dimethylisoxazol-4-yl)methyl]sulfanyl}thieno[2,3-d]pyrimidine
| Molecular Formula | C18H14ClN3OS2 |
|---|---|
| Molecular Weight | 387.03 g/mol |
| LogP | 5.90884 |
| Topological Polar Surface Area | 51.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 387.02667 |
| Heavy Atoms | 25 |
| Complexity | 1020.84985 |
Chemical Identifiers
| CAS Number | 315684-23-2 |
|---|---|
| SMILES | CC1=C(C(=NO1)C)CSC2=NC=NC3=C2C(=CS3)C4=CC=C(C=C4)Cl |
Product Overview
AF-399/40634492 (CAS 315684-23-2), with molecular formula C18H14ClN3OS2 and molecular weight 387.03 g/mol. IUPAC: 4-[[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylmethyl]-3,5-dimethyl-1,2-oxazole.
Chemical Property Profile of AF-399/40634492
Property Insights of AF-399/40634492
The XLogP value of 5.90884 indicates that AF-399/40634492 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.81 Ų, AF-399/40634492 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AF-399/40634492 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AF-399/40634492?
The CAS number of AF-399/40634492 is 315684-23-2.
What is the molecular formula of AF-399/40634492?
The molecular formula of AF-399/40634492 is C18H14ClN3OS2.
What is the molecular weight of AF-399/40634492?
The molecular weight of AF-399/40634492 is 387.03 g/mol.
Where can I buy AF-399/40634492?
You can request a quote for AF-399/40634492 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/40634492?
Yes, KEHONG BIO provides custom synthesis services for AF-399/40634492 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.