BIM-0029824.P001
TL;DR: BIM-0029824.P001 (CAS 5741-71-9) is a chemical compound with molecular formula C20H19BrN2O2S and molecular weight 430.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-(4-bromophenyl)-4-methyl-3-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate
Also Known As: BIM-0029824.P001, ethyl 6-(4-bromophenyl)-4-methyl-3-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate, Ethyl 4-(4-bromophenyl)-6-methyl-1-phenyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate, ethyl 4-(4-bromophenyl)-6-methyl-1-phenyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
| Molecular Formula | C20H19BrN2O2S |
|---|---|
| Molecular Weight | 430.04 g/mol |
| LogP | 4.722 |
| Topological Polar Surface Area | 41.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 430.03506 |
| Heavy Atoms | 26 |
| Complexity | 849.8747 |
Chemical Identifiers
| CAS Number | 5741-71-9 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(C(=S)NC1C2=CC=C(C=C2)Br)C3=CC=CC=C3)C |
Product Overview
BIM-0029824.P001 (CAS 5741-71-9), with molecular formula C20H19BrN2O2S and molecular weight 430.04 g/mol. IUPAC: ethyl 6-(4-bromophenyl)-4-methyl-3-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate.
Chemical Property Profile of BIM-0029824.P001
Property Insights of BIM-0029824.P001
The XLogP value of 4.722 indicates that BIM-0029824.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.57 Ų, BIM-0029824.P001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BIM-0029824.P001 has 1 hydrogen bond donor(s) and 3 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-0029824.P001?
The CAS number of BIM-0029824.P001 is 5741-71-9.
What is the molecular formula of BIM-0029824.P001?
The molecular formula of BIM-0029824.P001 is C20H19BrN2O2S.
What is the molecular weight of BIM-0029824.P001?
The molecular weight of BIM-0029824.P001 is 430.04 g/mol.
Where can I buy BIM-0029824.P001?
You can request a quote for BIM-0029824.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0029824.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0029824.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.