A3652/0154925
TL;DR: A3652/0154925 (CAS 497247-46-8) is a chemical compound with molecular formula C28H27N5O3S2 and molecular weight 545.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-methoxyphenyl)-2-[[8-oxo-7-(2-phenylethyl)-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-3-yl]sulfanyl]acetamide
Also Known As: A3652/0154925, N-(4-methoxyphenyl)-2-{[5-oxo-4-(2-phenylethyl)-4,5,6,7,8,9-hexahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]sulfanyl}acetamide, N-(4-methoxyphenyl)-2-((5-oxo-4-phenethyl-4,5,6,7,8,9-hexahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)thio)acetamide
| Molecular Formula | C28H27N5O3S2 |
|---|---|
| Molecular Weight | 545.16 g/mol |
| LogP | 4.9666 |
| Topological Polar Surface Area | 90.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 545.1555 |
| Heavy Atoms | 38 |
| Complexity | 1672.784 |
Chemical Identifiers
| CAS Number | 497247-46-8 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC(=O)CSC2=NN=C3N2C4=C(C5=C(S4)CCCC5)C(=O)N3CCC6=CC=CC=C6 |
Product Overview
A3652/0154925 (CAS 497247-46-8), with molecular formula C28H27N5O3S2 and molecular weight 545.16 g/mol. IUPAC: N-(4-methoxyphenyl)-2-[[8-oxo-7-(2-phenylethyl)-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-3-yl]sulfanyl]acetamide.
Chemical Property Profile of A3652/0154925
Property Insights of A3652/0154925
The XLogP value of 4.9666 indicates that A3652/0154925 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.52 Ų falls within the moderate polarity range, balancing permeability and solubility for A3652/0154925. Following Lipinski's Rule of Five, A3652/0154925 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A3652/0154925?
The CAS number of A3652/0154925 is 497247-46-8.
What is the molecular formula of A3652/0154925?
The molecular formula of A3652/0154925 is C28H27N5O3S2.
What is the molecular weight of A3652/0154925?
The molecular weight of A3652/0154925 is 545.16 g/mol.
Where can I buy A3652/0154925?
You can request a quote for A3652/0154925 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3652/0154925?
Yes, KEHONG BIO provides custom synthesis services for A3652/0154925 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.