AB00668720-01
TL;DR: AB00668720-01 (CAS 686771-48-2) is a chemical compound with molecular formula C20H19N3O3S2 and molecular weight 413.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(furan-2-ylmethyl)-2-[[3-(4-methylphenyl)-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]acetamide
Also Known As: AB00668720-01, F0579-0134, N-(furan-2-ylmethyl)-2-((4-oxo-3-(p-tolyl)-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl)thio)acetamide, N-(furan-2-ylmethyl)-2-[[3-(4-methylphenyl)-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]acetamide, N-[(furan-2-yl)methyl]-2-{[3-(4-methylphenyl)-4-oxo-3H,4H,6H,7H-thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
| Molecular Formula | C20H19N3O3S2 |
|---|---|
| Molecular Weight | 413.09 g/mol |
| LogP | 3.19062 |
| Topological Polar Surface Area | 77.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 413.0868 |
| Heavy Atoms | 28 |
| Complexity | 1043.803 |
Chemical Identifiers
| CAS Number | 686771-48-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=O)C3=C(CCS3)N=C2SCC(=O)NCC4=CC=CO4 |
Product Overview
AB00668720-01 (CAS 686771-48-2), with molecular formula C20H19N3O3S2 and molecular weight 413.09 g/mol. IUPAC: N-(furan-2-ylmethyl)-2-[[3-(4-methylphenyl)-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]acetamide.
Chemical Property Profile of AB00668720-01
Property Insights of AB00668720-01
The XLogP value of 3.19062 indicates that AB00668720-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.13 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00668720-01. Following Lipinski's Rule of Five, AB00668720-01 has 1 hydrogen bond donor(s) and 6 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 AB00668720-01?
The CAS number of AB00668720-01 is 686771-48-2.
What is the molecular formula of AB00668720-01?
The molecular formula of AB00668720-01 is C20H19N3O3S2.
What is the molecular weight of AB00668720-01?
The molecular weight of AB00668720-01 is 413.09 g/mol.
Where can I buy AB00668720-01?
You can request a quote for AB00668720-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00668720-01?
Yes, KEHONG BIO provides custom synthesis services for AB00668720-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.