BIM-0016187.P001
TL;DR: BIM-0016187.P001 (CAS 328562-29-4) is a chemical compound with molecular formula C18H14N2O5S and molecular weight 370.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[5-[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]furan-2-yl]benzoate
Also Known As: BIM-0016187.P001, ethyl 4-[5-[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]furan-2-yl]benzoate, ethyl 4-{5-[(4,6-dioxo-2-thioxo-1,3-dihydropyrimidin-5-ylidene)methyl]-2-furyl }benzoate, ethyl 4-{5-[(4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-2-furyl}benzoate, ethyl 4-(5-((4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl)furan-2-yl)benzoate
| Molecular Formula | C18H14N2O5S |
|---|---|
| Molecular Weight | 370.06 g/mol |
| LogP | 2.0376 |
| Topological Polar Surface Area | 97.64 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 370.06235 |
| Heavy Atoms | 26 |
| Complexity | 905.31305 |
Chemical Identifiers
| CAS Number | 328562-29-4 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=C3C(=O)NC(=S)NC3=O |
Product Overview
BIM-0016187.P001 (CAS 328562-29-4), with molecular formula C18H14N2O5S and molecular weight 370.06 g/mol. IUPAC: ethyl 4-[5-[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]furan-2-yl]benzoate.
Chemical Property Profile of BIM-0016187.P001
Property Insights of BIM-0016187.P001
The XLogP value of 2.0376 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BIM-0016187.P001. The TPSA of 97.64 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0016187.P001. Following Lipinski's Rule of Five, BIM-0016187.P001 has 2 hydrogen bond donor(s) and 6 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-0016187.P001?
The CAS number of BIM-0016187.P001 is 328562-29-4.
What is the molecular formula of BIM-0016187.P001?
The molecular formula of BIM-0016187.P001 is C18H14N2O5S.
What is the molecular weight of BIM-0016187.P001?
The molecular weight of BIM-0016187.P001 is 370.06 g/mol.
Where can I buy BIM-0016187.P001?
You can request a quote for BIM-0016187.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0016187.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0016187.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.