A 585
TL;DR: A 585 (CAS 577765-14-1) is a chemical compound with molecular formula C28H25N3O4S2 and molecular weight 531.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-methoxydibenzofuran-3-yl)-2-[(4-oxo-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide
Also Known As: A 585, ACETAMIDE,2-[[3,4,5,6,7,8-HEXAHYDRO-4-OXO-3-(2-ALLYL)[1]BENZOTHIENO[2,3-D]PYRIMIDIN-2-YL]THIO]-N-(2-METHOXY-3-DIBENZOFURANYL)-, 2-[(3-Allyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d], Acetamide, 2-[[3,4,5,6,7,8-hexahydro-4-oxo-3-(2-propenyl)[1]benzothieno[2,3-d]pyrimidin-2-yl]thio]-N-(2-methoxy-3-dibenzofuranyl)- (9CI), 2-((3-allyl-4-oxo-3,4,5,6,7,8-hexahydrobenzo[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)-N-(2-methoxydibenzo[b,d]furan-3-yl)acetamide
| Molecular Formula | C28H25N3O4S2 |
|---|---|
| Molecular Weight | 531.13 g/mol |
| LogP | 6.1616 |
| Topological Polar Surface Area | 86.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 531.12866 |
| Heavy Atoms | 37 |
| Complexity | 1747.8999 |
Chemical Identifiers
| CAS Number | 577765-14-1 |
|---|---|
| SMILES | COC1=C(C=C2C(=C1)C3=CC=CC=C3O2)NC(=O)CSC4=NC5=C(C6=C(S5)CCCC6)C(=O)N4CC=C |
Product Overview
A 585 (CAS 577765-14-1), with molecular formula C28H25N3O4S2 and molecular weight 531.13 g/mol. IUPAC: N-(2-methoxydibenzofuran-3-yl)-2-[(4-oxo-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide.
Chemical Property Profile of A 585
Property Insights of A 585
The XLogP value of 6.1616 indicates that A 585 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.36 Ų falls within the moderate polarity range, balancing permeability and solubility for A 585. Following Lipinski's Rule of Five, A 585 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 A 585?
The CAS number of A 585 is 577765-14-1.
What is the molecular formula of A 585?
The molecular formula of A 585 is C28H25N3O4S2.
What is the molecular weight of A 585?
The molecular weight of A 585 is 531.13 g/mol.
Where can I buy A 585?
You can request a quote for A 585 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A 585?
Yes, KEHONG BIO provides custom synthesis services for A 585 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.