F1008-0259
TL;DR: F1008-0259 (CAS 380342-97-2) is a chemical compound with molecular formula C25H21ClN4O4S2 and molecular weight 540.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[[2-[[3-(5-chloro-2-pyridinyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetyl]amino]benzoate
Also Known As: F1008-0259, methyl 4-(2-((3-(5-chloropyridin-2-yl)-4-oxo-3,4,5,6,7,8-hexahydrobenzo[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)acetamido)benzoate, methyl 4-(2-{[4-(5-chloropyridin-2-yl)-3-oxo-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-5-yl]sulfanyl}acetamido)benzoate, methyl 4-[[2-[[3-(5-chloropyridin-2-yl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetyl]amino]benzoate
| Molecular Formula | C25H21ClN4O4S2 |
|---|---|
| Molecular Weight | 540.07 g/mol |
| LogP | 4.8918 |
| Topological Polar Surface Area | 103.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 540.0693 |
| Heavy Atoms | 36 |
| Complexity | 1514.5918 |
Chemical Identifiers
| CAS Number | 380342-97-2 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2C5=NC=C(C=C5)Cl |
Product Overview
F1008-0259 (CAS 380342-97-2), with molecular formula C25H21ClN4O4S2 and molecular weight 540.07 g/mol. IUPAC: methyl 4-[[2-[[3-(5-chloro-2-pyridinyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetyl]amino]benzoate.
Chemical Property Profile of F1008-0259
Property Insights of F1008-0259
The XLogP value of 4.8918 indicates that F1008-0259 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.18 Ų falls within the moderate polarity range, balancing permeability and solubility for F1008-0259. Following Lipinski's Rule of Five, F1008-0259 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F1008-0259?
The CAS number of F1008-0259 is 380342-97-2.
What is the molecular formula of F1008-0259?
The molecular formula of F1008-0259 is C25H21ClN4O4S2.
What is the molecular weight of F1008-0259?
The molecular weight of F1008-0259 is 540.07 g/mol.
Where can I buy F1008-0259?
You can request a quote for F1008-0259 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1008-0259?
Yes, KEHONG BIO provides custom synthesis services for F1008-0259 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.