AS-871/42864154
TL;DR: AS-871/42864154 (CAS 867136-76-3) is a chemical compound with molecular formula C18H18Cl2N2O3S and molecular weight 412.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 5-(2,4-dichlorophenyl)-2,7-dimethyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Also Known As: AS-871/42864154, propan-2-yl 5-(2,4-dichlorophenyl)-2,7-dimethyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, isopropyl 5-(2,4-dichlorophenyl)-2,7-dimethyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, propan-2-yl 5-(2,4-dichlorophenyl)-2,7-dimethyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
| Molecular Formula | C18H18Cl2N2O3S |
|---|---|
| Molecular Weight | 412.04 g/mol |
| LogP | 4.5936 |
| Topological Polar Surface Area | 58.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 412.0415 |
| Heavy Atoms | 26 |
| Complexity | 850.838 |
Chemical Identifiers
| CAS Number | 867136-76-3 |
|---|---|
| SMILES | CC1C(=O)N2C(C(=C(N=C2S1)C)C(=O)OC(C)C)C3=C(C=C(C=C3)Cl)Cl |
Product Overview
AS-871/42864154 (CAS 867136-76-3), with molecular formula C18H18Cl2N2O3S and molecular weight 412.04 g/mol. IUPAC: propan-2-yl 5-(2,4-dichlorophenyl)-2,7-dimethyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.
Chemical Property Profile of AS-871/42864154
Property Insights of AS-871/42864154
The XLogP value of 4.5936 indicates that AS-871/42864154 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.97 Ų, AS-871/42864154 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AS-871/42864154 has 0 hydrogen bond donor(s) and 5 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-871/42864154?
The CAS number of AS-871/42864154 is 867136-76-3.
What is the molecular formula of AS-871/42864154?
The molecular formula of AS-871/42864154 is C18H18Cl2N2O3S.
What is the molecular weight of AS-871/42864154?
The molecular weight of AS-871/42864154 is 412.04 g/mol.
Where can I buy AS-871/42864154?
You can request a quote for AS-871/42864154 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AS-871/42864154?
Yes, KEHONG BIO provides custom synthesis services for AS-871/42864154 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.