AS-871/42446714
TL;DR: AS-871/42446714 (CAS 1095933-34-8) is a chemical compound with molecular formula C15H15NOS3 and molecular weight 321.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-thiophen-2-yl-3,7-dithia-5-azatetracyclo[9.2.1.02,10.04,8]tetradec-4(8)-en-6-one
Also Known As: AS-871/42446714, 9-(thiophen-2-yl)-3,4a,5,6,7,8,8a,9-octahydro-2H-5,8-methanothiochromeno[2,3-d]thiazol-2-one, F1553-0154, 9-(2-thienyl)-3,7-dithia-5-azatetracyclo[9.2.1.0~2,10~.0~4,8~]tetradec-4(8)-en-6-one, 3-(2-thienyl)-5,9-dithia-7-azatetracyclo[9.2.1.0<2,10>.0<4,8>]tetradec-4(8)-en -6-one
| Molecular Formula | C15H15NOS3 |
|---|---|
| Molecular Weight | 321.03 g/mol |
| LogP | 4.1502 |
| Topological Polar Surface Area | 32.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 321.0316 |
| Heavy Atoms | 20 |
| Complexity | 701.0271 |
Chemical Identifiers
| CAS Number | 1095933-34-8 |
|---|---|
| SMILES | C1CC2CC1C3C2SC4=C(C3C5=CC=CS5)SC(=O)N4 |
Product Overview
AS-871/42446714 (CAS 1095933-34-8), with molecular formula C15H15NOS3 and molecular weight 321.03 g/mol. IUPAC: 9-thiophen-2-yl-3,7-dithia-5-azatetracyclo[9.2.1.02,10.04,8]tetradec-4(8)-en-6-one.
Chemical Property Profile of AS-871/42446714
Property Insights of AS-871/42446714
The XLogP value of 4.1502 indicates that AS-871/42446714 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.86 Ų, AS-871/42446714 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AS-871/42446714 has 1 hydrogen bond donor(s) and 4 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 AS-871/42446714?
The CAS number of AS-871/42446714 is 1095933-34-8.
What is the molecular formula of AS-871/42446714?
The molecular formula of AS-871/42446714 is C15H15NOS3.
What is the molecular weight of AS-871/42446714?
The molecular weight of AS-871/42446714 is 321.03 g/mol.
Where can I buy AS-871/42446714?
You can request a quote for AS-871/42446714 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AS-871/42446714?
Yes, KEHONG BIO provides custom synthesis services for AS-871/42446714 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.