BAS 00371999
TL;DR: BAS 00371999 (CAS 331272-59-4) is a chemical compound with molecular formula C16H14BrN3O2S and molecular weight 391.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-bromophenyl)-6-methyl-2-oxo-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxamide
Also Known As: BAS 00371999, N-(4-bromophenyl)-6-methyl-2-oxo-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxamide, N-(4-bromophenyl)-6-methyl-2-oxo-4-(2-thienyl)-1,2,3,4-tetrahydro-5-pyrimidinecarboxamide, N-(4-bromophenyl)(4-methyl-2-oxo-6-(2-thienyl)(1,3,6-trihydropyrimidin-5-yl))c arboxamide
| Molecular Formula | C16H14BrN3O2S |
|---|---|
| Molecular Weight | 391.00 g/mol |
| LogP | 3.7772 |
| Topological Polar Surface Area | 70.23 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 390.99902 |
| Heavy Atoms | 23 |
| Complexity | 769.1329 |
Chemical Identifiers
| CAS Number | 331272-59-4 |
|---|---|
| SMILES | CC1=C(C(NC(=O)N1)C2=CC=CS2)C(=O)NC3=CC=C(C=C3)Br |
Product Overview
BAS 00371999 (CAS 331272-59-4), with molecular formula C16H14BrN3O2S and molecular weight 391.00 g/mol. IUPAC: N-(4-bromophenyl)-6-methyl-2-oxo-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxamide.
Chemical Property Profile of BAS 00371999
Property Insights of BAS 00371999
The XLogP value of 3.7772 indicates that BAS 00371999 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 00371999. Following Lipinski's Rule of Five, BAS 00371999 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 00371999?
The CAS number of BAS 00371999 is 331272-59-4.
What is the molecular formula of BAS 00371999?
The molecular formula of BAS 00371999 is C16H14BrN3O2S.
What is the molecular weight of BAS 00371999?
The molecular weight of BAS 00371999 is 391.00 g/mol.
Where can I buy BAS 00371999?
You can request a quote for BAS 00371999 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00371999?
Yes, KEHONG BIO provides custom synthesis services for BAS 00371999 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.