AB00409301-04
TL;DR: AB00409301-04 (CAS 851409-45-5) is a chemical compound with molecular formula C19H21N3O4S2 and molecular weight 419.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(3-ethyl-6-methyl-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetamide
Also Known As: AB00409301-04, F0612-0108, N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-({3-ethyl-6-methyl-4-oxo-3H,4H,6H,7H-thieno[3,2-d]pyrimidin-2-yl}sulfanyl)acetamide, N-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-2-((3-ethyl-6-methyl-4-oxo-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl)thio)acetamide, N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(3-ethyl-6-methyl-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetamide
| Molecular Formula | C19H21N3O4S2 |
|---|---|
| Molecular Weight | 419.10 g/mol |
| LogP | 2.8019 |
| Topological Polar Surface Area | 82.45 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 419.09735 |
| Heavy Atoms | 28 |
| Complexity | 976.3816 |
Chemical Identifiers
| CAS Number | 851409-45-5 |
|---|---|
| SMILES | CCN1C(=O)C2=C(CC(S2)C)N=C1SCC(=O)NC3=CC4=C(C=C3)OCCO4 |
Product Overview
AB00409301-04 (CAS 851409-45-5), with molecular formula C19H21N3O4S2 and molecular weight 419.10 g/mol. IUPAC: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(3-ethyl-6-methyl-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetamide.
Chemical Property Profile of AB00409301-04
Property Insights of AB00409301-04
The XLogP value of 2.8019 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00409301-04. The TPSA of 82.45 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00409301-04. Following Lipinski's Rule of Five, AB00409301-04 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 AB00409301-04?
The CAS number of AB00409301-04 is 851409-45-5.
What is the molecular formula of AB00409301-04?
The molecular formula of AB00409301-04 is C19H21N3O4S2.
What is the molecular weight of AB00409301-04?
The molecular weight of AB00409301-04 is 419.10 g/mol.
Where can I buy AB00409301-04?
You can request a quote for AB00409301-04 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00409301-04?
Yes, KEHONG BIO provides custom synthesis services for AB00409301-04 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.