F1601-0501
TL;DR: F1601-0501 (CAS 866014-94-0) is a chemical compound with molecular formula C27H22N4O3S2 and molecular weight 514.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(furan-2-ylmethyl)-2-[[3-[2-(1H-indol-3-yl)ethyl]-4-oxo-[1]benzothiolo[3,2-d]pyrimidin-2-yl]sulfanyl]acetamide
Also Known As: F1601-0501, N-(furan-2-ylmethyl)-2-[[3-[2-(1H-indol-3-yl)ethyl]-4-oxo-[1]benzothiolo[3,2-d]pyrimidin-2-yl]sulfanyl]acetamide, N-[(furan-2-yl)methyl]-2-({5-[2-(1H-indol-3-yl)ethyl]-6-oxo-8-thia-3,5-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),3,10,12-pentaen-4-yl}sulfanyl)acetamide, N-(2-furylmethyl)-2-({3-[2-(1H-indol-3-yl)ethyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}thio)acetamide, 2-((3-(2-(1H-indol-3-yl)ethyl)-4-oxo-3,4-dihydrobenzo[4,5]thieno[3,2-d]pyrimidin-2-yl)thio)-N-(furan-2-ylmethyl)acetamide
| Molecular Formula | C27H22N4O3S2 |
|---|---|
| Molecular Weight | 514.11 g/mol |
| LogP | 5.3367 |
| Topological Polar Surface Area | 92.92 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 514.11334 |
| Heavy Atoms | 36 |
| Complexity | 1748.025 |
Chemical Identifiers
| CAS Number | 866014-94-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2)CCN3C(=O)C4=C(C5=CC=CC=C5S4)N=C3SCC(=O)NCC6=CC=CO6 |
Product Overview
F1601-0501 (CAS 866014-94-0), with molecular formula C27H22N4O3S2 and molecular weight 514.11 g/mol. IUPAC: N-(furan-2-ylmethyl)-2-[[3-[2-(1H-indol-3-yl)ethyl]-4-oxo-[1]benzothiolo[3,2-d]pyrimidin-2-yl]sulfanyl]acetamide.
Chemical Property Profile of F1601-0501
Property Insights of F1601-0501
The XLogP value of 5.3367 indicates that F1601-0501 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.92 Ų falls within the moderate polarity range, balancing permeability and solubility for F1601-0501. Following Lipinski's Rule of Five, F1601-0501 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F1601-0501?
The CAS number of F1601-0501 is 866014-94-0.
What is the molecular formula of F1601-0501?
The molecular formula of F1601-0501 is C27H22N4O3S2.
What is the molecular weight of F1601-0501?
The molecular weight of F1601-0501 is 514.11 g/mol.
Where can I buy F1601-0501?
You can request a quote for F1601-0501 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1601-0501?
Yes, KEHONG BIO provides custom synthesis services for F1601-0501 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.