A0532/0024578
TL;DR: A0532/0024578 (CAS 339582-44-4) is a chemical compound with molecular formula C27H28N4O4S and molecular weight 504.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 6-amino-5-cyano-2-[(3-cyano-4,5,6-trimethyl-2-pyridinyl)sulfanylmethyl]-4-(4-methoxyphenyl)-4H-pyran-3-carboxylate
Also Known As: A0532/0024578, propan-2-yl 6-amino-5-cyano-2-{[(3-cyano-4,5,6-trimethylpyridin-2-yl)sulfanyl]methyl}-4-(4-methoxyphenyl)-4H-pyran-3-carboxylate, isopropyl 6-amino-5-cyano-2-(((3-cyano-4,5,6-trimethylpyridin-2-yl)thio)methyl)-4-(4-methoxyphenyl)-4H-pyran-3-carboxylate, propan-2-yl 6-amino-5-cyano-2-[(3-cyano-4,5,6-trimethylpyridin-2-yl)sulfanylmethyl]-4-(4-methoxyphenyl)-4H-pyran-3-carboxylate
| Molecular Formula | C27H28N4O4S |
|---|---|
| Molecular Weight | 504.18 g/mol |
| LogP | 4.69282 |
| Topological Polar Surface Area | 131.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 504.18314 |
| Heavy Atoms | 36 |
| Complexity | 1331.5131 |
Chemical Identifiers
| CAS Number | 339582-44-4 |
|---|---|
| SMILES | CC1=C(C(=C(N=C1C)SCC2=C(C(C(=C(O2)N)C#N)C3=CC=C(C=C3)OC)C(=O)OC(C)C)C#N)C |
Product Overview
A0532/0024578 (CAS 339582-44-4), with molecular formula C27H28N4O4S and molecular weight 504.18 g/mol. IUPAC: propan-2-yl 6-amino-5-cyano-2-[(3-cyano-4,5,6-trimethyl-2-pyridinyl)sulfanylmethyl]-4-(4-methoxyphenyl)-4H-pyran-3-carboxylate.
Chemical Property Profile of A0532/0024578
Property Insights of A0532/0024578
The XLogP value of 4.69282 indicates that A0532/0024578 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 131.25 Ų falls within the moderate polarity range, balancing permeability and solubility for A0532/0024578. Following Lipinski's Rule of Five, A0532/0024578 has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A0532/0024578?
The CAS number of A0532/0024578 is 339582-44-4.
What is the molecular formula of A0532/0024578?
The molecular formula of A0532/0024578 is C27H28N4O4S.
What is the molecular weight of A0532/0024578?
The molecular weight of A0532/0024578 is 504.18 g/mol.
Where can I buy A0532/0024578?
You can request a quote for A0532/0024578 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A0532/0024578?
Yes, KEHONG BIO provides custom synthesis services for A0532/0024578 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.