RefChem:355363
TL;DR: RefChem:355363 (CAS 299404-81-2) is a chemical compound with molecular formula C13H13BrN2O3 and molecular weight 324.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-(3-bromophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: methyl 4-(3-bromophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, CHEMBRDG-BB 5469887, CHEMBRDG-BB5469887, BAS 00188357, J1.616.275B
| Molecular Formula | C13H13BrN2O3 |
|---|---|
| Molecular Weight | 324.01 g/mol |
| LogP | 2.25 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 324.01096 |
| Heavy Atoms | 19 |
| Complexity | 568.76166 |
Chemical Identifiers
| CAS Number | 299404-81-2 |
|---|---|
| SMILES | CC1=C(C(NC(=O)N1)C2=CC(=CC=C2)Br)C(=O)OC |
Product Overview
RefChem:355363 (CAS 299404-81-2), with molecular formula C13H13BrN2O3 and molecular weight 324.01 g/mol. IUPAC: methyl 4-(3-bromophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of RefChem:355363
Property Insights of RefChem:355363
The XLogP value of 2.25 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:355363. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:355363. Following Lipinski's Rule of Five, RefChem:355363 has 2 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 RefChem:355363?
The CAS number of RefChem:355363 is 299404-81-2.
What is the molecular formula of RefChem:355363?
The molecular formula of RefChem:355363 is C13H13BrN2O3.
What is the molecular weight of RefChem:355363?
The molecular weight of RefChem:355363 is 324.01 g/mol.
Where can I buy RefChem:355363?
You can request a quote for RefChem:355363 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:355363?
Yes, KEHONG BIO provides custom synthesis services for RefChem:355363 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.