AB00409309-05
TL;DR: AB00409309-05 (CAS 851409-52-4) is a chemical compound with molecular formula C18H18N4O2S3 and molecular weight 418.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzothiazol-2-yl)-2-[(3-ethyl-6-methyl-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetamide
Also Known As: AB00409309-05, F0612-0114, N-(1,3-benzothiazol-2-yl)-2-[(3-ethyl-6-methyl-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetamide, N-(benzo[d]thiazol-2-yl)-2-((3-ethyl-6-methyl-4-oxo-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl)thio)acetamide, N-1,3-benzothiazol-2-yl-2-[(3-ethyl-6-methyl-4-oxo-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl)thio]acetamide
| Molecular Formula | C18H18N4O2S3 |
|---|---|
| Molecular Weight | 418.06 g/mol |
| LogP | 3.6404 |
| Topological Polar Surface Area | 76.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 418.0592 |
| Heavy Atoms | 27 |
| Complexity | 1043.1443 |
Chemical Identifiers
| CAS Number | 851409-52-4 |
|---|---|
| SMILES | CCN1C(=O)C2=C(CC(S2)C)N=C1SCC(=O)NC3=NC4=CC=CC=C4S3 |
Product Overview
AB00409309-05 (CAS 851409-52-4), with molecular formula C18H18N4O2S3 and molecular weight 418.06 g/mol. IUPAC: N-(1,3-benzothiazol-2-yl)-2-[(3-ethyl-6-methyl-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetamide.
Chemical Property Profile of AB00409309-05
Property Insights of AB00409309-05
The XLogP value of 3.6404 indicates that AB00409309-05 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.88 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00409309-05. Following Lipinski's Rule of Five, AB00409309-05 has 1 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 AB00409309-05?
The CAS number of AB00409309-05 is 851409-52-4.
What is the molecular formula of AB00409309-05?
The molecular formula of AB00409309-05 is C18H18N4O2S3.
What is the molecular weight of AB00409309-05?
The molecular weight of AB00409309-05 is 418.06 g/mol.
Where can I buy AB00409309-05?
You can request a quote for AB00409309-05 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00409309-05?
Yes, KEHONG BIO provides custom synthesis services for AB00409309-05 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.