AMS_CNC_ID-444049791
TL;DR: AMS_CNC_ID-444049791 (CAS 740813-84-7) is a chemical compound with molecular formula C20H16BrN5O2S and molecular weight 469.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-bromophenyl)-2-[[4-(furan-2-ylmethyl)-5-pyridin-2-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: AMS_CNC_ID-444049791, N-(2-bromophenyl)-2-{[4-(furan-2-ylmethyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide, N-(2-bromophenyl)-2-[4-(2-furylmethyl)-5-(2-pyridyl)(1,2,4-triazol-3-ylthio)]a cetamide, N-(2-bromophenyl)-2-((4-(furan-2-ylmethyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide, N-(2-bromophenyl)-2-[[4-(2-furylmethyl)-5-pyridin-2-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide
| Molecular Formula | C20H16BrN5O2S |
|---|---|
| Molecular Weight | 469.02 g/mol |
| LogP | 4.4747 |
| Topological Polar Surface Area | 85.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 469.0208 |
| Heavy Atoms | 29 |
| Complexity | 1099.2842 |
Chemical Identifiers
| CAS Number | 740813-84-7 |
|---|---|
| SMILES | C1=CC=C(C(=C1)NC(=O)CSC2=NN=C(N2CC3=CC=CO3)C4=CC=CC=N4)Br |
Product Overview
AMS_CNC_ID-444049791 (CAS 740813-84-7), with molecular formula C20H16BrN5O2S and molecular weight 469.02 g/mol. IUPAC: N-(2-bromophenyl)-2-[[4-(furan-2-ylmethyl)-5-pyridin-2-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of AMS_CNC_ID-444049791
Property Insights of AMS_CNC_ID-444049791
The XLogP value of 4.4747 indicates that AMS_CNC_ID-444049791 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.84 Ų falls within the moderate polarity range, balancing permeability and solubility for AMS_CNC_ID-444049791. Following Lipinski's Rule of Five, AMS_CNC_ID-444049791 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 AMS_CNC_ID-444049791?
The CAS number of AMS_CNC_ID-444049791 is 740813-84-7.
What is the molecular formula of AMS_CNC_ID-444049791?
The molecular formula of AMS_CNC_ID-444049791 is C20H16BrN5O2S.
What is the molecular weight of AMS_CNC_ID-444049791?
The molecular weight of AMS_CNC_ID-444049791 is 469.02 g/mol.
Where can I buy AMS_CNC_ID-444049791?
You can request a quote for AMS_CNC_ID-444049791 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AMS_CNC_ID-444049791?
Yes, KEHONG BIO provides custom synthesis services for AMS_CNC_ID-444049791 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.