BIM-0004086.P001
TL;DR: BIM-0004086.P001 (CAS 306309-60-4) is a chemical compound with molecular formula C23H22N2O4S2 and molecular weight 454.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2Z)-7-methyl-2-[(5-methylfuran-2-yl)methylidene]-5-(4-methylsulfanylphenyl)-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Also Known As: BIM-0004086.P001, ethyl (2Z)-7-methyl-2-[(5-methylfuran-2-yl)methylidene]-5-[4-(methylsulfanyl)phenyl]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, (Z)-ethyl 7-methyl-2-((5-methylfuran-2-yl)methylene)-5-(4-(methylthio)phenyl)-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate, ethyl (2Z)-7-methyl-2-[(5-methylfuran-2-yl)methylidene]-5-(4-methylsulfanylphenyl)-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, ETHYL (2Z)-7-METHYL-2-[(5-METHYLFURAN-2-YL)METHYLIDENE]-5-[4-(METHYLSULFANYL)PHENYL]-3-OXO-2H,3H,5H-[1,3]THIAZOLO[3,2-A]PYRIMIDINE-6-CARBOXYLATE
| Molecular Formula | C23H22N2O4S2 |
|---|---|
| Molecular Weight | 454.10 g/mol |
| LogP | 3.42162 |
| Topological Polar Surface Area | 73.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 454.1021 |
| Heavy Atoms | 31 |
| Complexity | 1343.3489 |
Chemical Identifiers
| CAS Number | 306309-60-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)SC)C(=O)/C(=C/C4=CC=C(O4)C)/S2)C |
Product Overview
BIM-0004086.P001 (CAS 306309-60-4), with molecular formula C23H22N2O4S2 and molecular weight 454.10 g/mol. IUPAC: ethyl (2Z)-7-methyl-2-[(5-methylfuran-2-yl)methylidene]-5-(4-methylsulfanylphenyl)-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.
Chemical Property Profile of BIM-0004086.P001
Property Insights of BIM-0004086.P001
The XLogP value of 3.42162 indicates that BIM-0004086.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.8 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0004086.P001. Following Lipinski's Rule of Five, BIM-0004086.P001 has 0 hydrogen bond donor(s) and 7 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 BIM-0004086.P001?
The CAS number of BIM-0004086.P001 is 306309-60-4.
What is the molecular formula of BIM-0004086.P001?
The molecular formula of BIM-0004086.P001 is C23H22N2O4S2.
What is the molecular weight of BIM-0004086.P001?
The molecular weight of BIM-0004086.P001 is 454.10 g/mol.
Where can I buy BIM-0004086.P001?
You can request a quote for BIM-0004086.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0004086.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0004086.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.