AB00681751-01
TL;DR: AB00681751-01 (CAS 717876-07-8) is a chemical compound with molecular formula C20H17N3O3S2 and molecular weight 411.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(furan-2-ylmethyl)-6-methyl-4-oxothieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-phenylacetamide
Also Known As: AB00681751-01, F3007-0349, 2-({3-[(furan-2-yl)methyl]-6-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidin-2-yl}sulfanyl)-N-phenylacetamide, 2-[3-(furan-2-ylmethyl)-6-methyl-4-oxothieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-phenylacetamide, 2-((3-(furan-2-ylmethyl)-6-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)thio)-N-phenylacetamide
| Molecular Formula | C20H17N3O3S2 |
|---|---|
| Molecular Weight | 411.07 g/mol |
| LogP | 4.13852 |
| Topological Polar Surface Area | 77.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 411.07114 |
| Heavy Atoms | 28 |
| Complexity | 1164.8545 |
Chemical Identifiers
| CAS Number | 717876-07-8 |
|---|---|
| SMILES | CC1=CC2=C(S1)N=C(N(C2=O)CC3=CC=CO3)SCC(=O)NC4=CC=CC=C4 |
Product Overview
AB00681751-01 (CAS 717876-07-8), with molecular formula C20H17N3O3S2 and molecular weight 411.07 g/mol. IUPAC: 2-[3-(furan-2-ylmethyl)-6-methyl-4-oxothieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-phenylacetamide.
Chemical Property Profile of AB00681751-01
Property Insights of AB00681751-01
The XLogP value of 4.13852 indicates that AB00681751-01 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 AB00681751-01. Following Lipinski's Rule of Five, AB00681751-01 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 AB00681751-01?
The CAS number of AB00681751-01 is 717876-07-8.
What is the molecular formula of AB00681751-01?
The molecular formula of AB00681751-01 is C20H17N3O3S2.
What is the molecular weight of AB00681751-01?
The molecular weight of AB00681751-01 is 411.07 g/mol.
Where can I buy AB00681751-01?
You can request a quote for AB00681751-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00681751-01?
Yes, KEHONG BIO provides custom synthesis services for AB00681751-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.