BIM-0028898.P001
TL;DR: BIM-0028898.P001 (CAS 311316-53-7) is a chemical compound with molecular formula C21H27N3O5S and molecular weight 433.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[3-methoxy-4-(2-oxo-2-piperidin-1-ylethoxy)phenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: BIM-0028898.P001, AB00094231-01, A1207/0055610, methyl 4-[3-methoxy-4-(2-oxo-2-piperidin-1-ylethoxy)phenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate, methyl 4-(3-methoxy-4-(2-oxo-2-(piperidin-1-yl)ethoxy)phenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
| Molecular Formula | C21H27N3O5S |
|---|---|
| Molecular Weight | 433.17 g/mol |
| LogP | 2.0523 |
| Topological Polar Surface Area | 89.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 433.16714 |
| Heavy Atoms | 30 |
| Complexity | 864.1979 |
Chemical Identifiers
| CAS Number | 311316-53-7 |
|---|---|
| SMILES | CC1=C(C(NC(=S)N1)C2=CC(=C(C=C2)OCC(=O)N3CCCCC3)OC)C(=O)OC |
Product Overview
BIM-0028898.P001 (CAS 311316-53-7), with molecular formula C21H27N3O5S and molecular weight 433.17 g/mol. IUPAC: methyl 4-[3-methoxy-4-(2-oxo-2-piperidin-1-ylethoxy)phenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of BIM-0028898.P001
Property Insights of BIM-0028898.P001
The XLogP value of 2.0523 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BIM-0028898.P001. The TPSA of 89.13 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0028898.P001. Following Lipinski's Rule of Five, BIM-0028898.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-0028898.P001?
The CAS number of BIM-0028898.P001 is 311316-53-7.
What is the molecular formula of BIM-0028898.P001?
The molecular formula of BIM-0028898.P001 is C21H27N3O5S.
What is the molecular weight of BIM-0028898.P001?
The molecular weight of BIM-0028898.P001 is 433.17 g/mol.
Where can I buy BIM-0028898.P001?
You can request a quote for BIM-0028898.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0028898.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0028898.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.