BAS 00943921
TL;DR: BAS 00943921 (CAS 5745-68-6) is a chemical compound with molecular formula C19H18BrN3O2S and molecular weight 431.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-bromophenyl)-N-(4-methoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide
Also Known As: BAS 00943921, 4-(2-bromophenyl)-N-(4-methoxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide, AJ-292/12641030, 4-(2-bromophenyl)-N-(4-methoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide, 4-(2-Bromo-phenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-pyrimidine-5-carboxylic
| Molecular Formula | C19H18BrN3O2S |
|---|---|
| Molecular Weight | 431.03 g/mol |
| LogP | 3.8892 |
| Topological Polar Surface Area | 62.39 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 431.0303 |
| Heavy Atoms | 26 |
| Complexity | 880.6079 |
Chemical Identifiers
| CAS Number | 5745-68-6 |
|---|---|
| SMILES | CC1=C(C(NC(=S)N1)C2=CC=CC=C2Br)C(=O)NC3=CC=C(C=C3)OC |
Product Overview
BAS 00943921 (CAS 5745-68-6), with molecular formula C19H18BrN3O2S and molecular weight 431.03 g/mol. IUPAC: 4-(2-bromophenyl)-N-(4-methoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide.
Chemical Property Profile of BAS 00943921
Property Insights of BAS 00943921
The XLogP value of 3.8892 indicates that BAS 00943921 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 00943921. Following Lipinski's Rule of Five, BAS 00943921 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 00943921?
The CAS number of BAS 00943921 is 5745-68-6.
What is the molecular formula of BAS 00943921?
The molecular formula of BAS 00943921 is C19H18BrN3O2S.
What is the molecular weight of BAS 00943921?
The molecular weight of BAS 00943921 is 431.03 g/mol.
Where can I buy BAS 00943921?
You can request a quote for BAS 00943921 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00943921?
Yes, KEHONG BIO provides custom synthesis services for BAS 00943921 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.