BAS 00943869
TL;DR: BAS 00943869 (CAS 333767-28-5) is a chemical compound with molecular formula C20H20ClN3O2S and molecular weight 401.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-chlorophenyl)-N-(4-ethoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide
Also Known As: BAS 00943869, 4-(4-chlorophenyl)-N-(4-ethoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide, 4-(4-chlorophenyl)-N-(4-ethoxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxamide, [6-(4-chlorophenyl)-4-methyl-2-thioxo(1,3,6-trihydropyrimidin-5-yl)]-N-(4-etho xyphenyl)carboxamide
| Molecular Formula | C20H20ClN3O2S |
|---|---|
| Molecular Weight | 401.10 g/mol |
| LogP | 4.1702 |
| Topological Polar Surface Area | 62.39 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 401.09647 |
| Heavy Atoms | 27 |
| Complexity | 879.10474 |
Chemical Identifiers
| CAS Number | 333767-28-5 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)NC(=O)C2=C(NC(=S)NC2C3=CC=C(C=C3)Cl)C |
Product Overview
BAS 00943869 (CAS 333767-28-5), with molecular formula C20H20ClN3O2S and molecular weight 401.10 g/mol. IUPAC: 4-(4-chlorophenyl)-N-(4-ethoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide.
Chemical Property Profile of BAS 00943869
Property Insights of BAS 00943869
The XLogP value of 4.1702 indicates that BAS 00943869 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.39 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00943869. Following Lipinski's Rule of Five, BAS 00943869 has 3 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 BAS 00943869?
The CAS number of BAS 00943869 is 333767-28-5.
What is the molecular formula of BAS 00943869?
The molecular formula of BAS 00943869 is C20H20ClN3O2S.
What is the molecular weight of BAS 00943869?
The molecular weight of BAS 00943869 is 401.10 g/mol.
Where can I buy BAS 00943869?
You can request a quote for BAS 00943869 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00943869?
Yes, KEHONG BIO provides custom synthesis services for BAS 00943869 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.