BAS 00944043
TL;DR: BAS 00944043 (CAS 333768-36-8) is a chemical compound with molecular formula C18H15BrClN3O2 and molecular weight 419.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-bromophenyl)-N-(4-chlorophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide
Also Known As: BAS 00944043, BIM-0031685.P001, AJ-292/12641066, 4-(2-bromophenyl)-N-(4-chlorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide, 4-(2-bromophenyl)-N-(4-chlorophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide
| Molecular Formula | C18H15BrClN3O2 |
|---|---|
| Molecular Weight | 419.00 g/mol |
| LogP | 4.3691 |
| Topological Polar Surface Area | 70.23 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 419.00363 |
| Heavy Atoms | 25 |
| Complexity | 864.8798 |
Chemical Identifiers
| CAS Number | 333768-36-8 |
|---|---|
| SMILES | CC1=C(C(NC(=O)N1)C2=CC=CC=C2Br)C(=O)NC3=CC=C(C=C3)Cl |
Product Overview
BAS 00944043 (CAS 333768-36-8), with molecular formula C18H15BrClN3O2 and molecular weight 419.00 g/mol. IUPAC: 4-(2-bromophenyl)-N-(4-chlorophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide.
Chemical Property Profile of BAS 00944043
Property Insights of BAS 00944043
The XLogP value of 4.3691 indicates that BAS 00944043 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.23 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00944043. Following Lipinski's Rule of Five, BAS 00944043 has 3 hydrogen bond donor(s) and 2 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 00944043?
The CAS number of BAS 00944043 is 333768-36-8.
What is the molecular formula of BAS 00944043?
The molecular formula of BAS 00944043 is C18H15BrClN3O2.
What is the molecular weight of BAS 00944043?
The molecular weight of BAS 00944043 is 419.00 g/mol.
Where can I buy BAS 00944043?
You can request a quote for BAS 00944043 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00944043?
Yes, KEHONG BIO provides custom synthesis services for BAS 00944043 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.