BIM-0009956.P001
TL;DR: BIM-0009956.P001 (CAS 353519-87-6) is a chemical compound with molecular formula C14H16N2O2S2 and molecular weight 308.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 6-methyl-4-(4-methylsulfanylphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: BIM-0009956.P001, AN-655/13869005, methyl 6-methyl-4-(4-methylsulfanylphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate, methyl 6-methyl-4-[4-(methylsulfanyl)phenyl]-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate, methyl 6-methyl-4-(4-(methylthio)phenyl)-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
| Molecular Formula | C14H16N2O2S2 |
|---|---|
| Molecular Weight | 308.07 g/mol |
| LogP | 2.3743 |
| Topological Polar Surface Area | 50.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 308.0653 |
| Heavy Atoms | 20 |
| Complexity | 567.04156 |
Chemical Identifiers
| CAS Number | 353519-87-6 |
|---|---|
| SMILES | CC1=C(C(NC(=S)N1)C2=CC=C(C=C2)SC)C(=O)OC |
Product Overview
BIM-0009956.P001 (CAS 353519-87-6), with molecular formula C14H16N2O2S2 and molecular weight 308.07 g/mol. IUPAC: methyl 6-methyl-4-(4-methylsulfanylphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of BIM-0009956.P001
Property Insights of BIM-0009956.P001
The XLogP value of 2.3743 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BIM-0009956.P001. With a topological polar surface area (TPSA) of 50.36 Ų, BIM-0009956.P001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BIM-0009956.P001 has 2 hydrogen bond donor(s) and 4 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-0009956.P001?
The CAS number of BIM-0009956.P001 is 353519-87-6.
What is the molecular formula of BIM-0009956.P001?
The molecular formula of BIM-0009956.P001 is C14H16N2O2S2.
What is the molecular weight of BIM-0009956.P001?
The molecular weight of BIM-0009956.P001 is 308.07 g/mol.
Where can I buy BIM-0009956.P001?
You can request a quote for BIM-0009956.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0009956.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0009956.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.