Phenylmethyl 6-(4-chlorophenyl)-1,2,3,4-tetrahydro-4-methyl-2-oxo-5-pyrimidinecarboxylate
TL;DR: Phenylmethyl 6-(4-chlorophenyl)-1,2,3,4-tetrahydro-4-methyl-2-oxo-5-pyrimidinecarboxylate (CAS 329923-16-2) is a chemical compound with molecular formula C19H17ClN2O3 and molecular weight 356.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl 6-(4-chlorophenyl)-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: Phenylmethyl 6-(4-chlorophenyl)-1,2,3,4-tetrahydro-4-methyl-2-oxo-5-pyrimidinecarboxylate, benzyl 6-(4-chlorophenyl)-4-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, benzyl 6-(4-chlorophenyl)-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate, phenylmethyl 4-(4-chlorophenyl)-6-methyl-2-oxo-1,3,6-trihydropyrimidine-5-carb oxylate
| Molecular Formula | C19H17ClN2O3 |
|---|---|
| Molecular Weight | 356.09 g/mol |
| LogP | 3.4958 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 356.09277 |
| Heavy Atoms | 25 |
| Complexity | 816.3227 |
Chemical Identifiers
| CAS Number | 329923-16-2 |
|---|---|
| SMILES | CC1C(=C(NC(=O)N1)C2=CC=C(C=C2)Cl)C(=O)OCC3=CC=CC=C3 |
Product Overview
Phenylmethyl 6-(4-chlorophenyl)-1,2,3,4-tetrahydro-4-methyl-2-oxo-5-pyrimidinecarboxylate (CAS 329923-16-2), with molecular formula C19H17ClN2O3 and molecular weight 356.09 g/mol. IUPAC: benzyl 6-(4-chlorophenyl)-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of Phenylmethyl 6-(4-chlorophenyl)-1,2,3,4-tetrahydro-4-methyl-2-oxo-5-pyrimidinecarboxylate
Property Insights of Phenylmethyl 6-(4-chlorophenyl)-1,2,3,4-tetrahydro-4-methyl-2-oxo-5-pyrimidinecarboxylate
The XLogP value of 3.4958 indicates that Phenylmethyl 6-(4-chlorophenyl)-1,2,3,4-tetrahydro-4-methyl-2-oxo-5-pyrimidinecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for Phenylmethyl 6-(4-chlorophenyl)-1,2,3,4-tetrahydro-4-methyl-2-oxo-5-pyrimidinecarboxylate. Following Lipinski's Rule of Five, Phenylmethyl 6-(4-chlorophenyl)-1,2,3,4-tetrahydro-4-methyl-2-oxo-5-pyrimidinecarboxylate 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 Phenylmethyl 6-(4-chlorophenyl)-1,2,3,4-tetrahydro-4-methyl-2-oxo-5-pyrimidinecarboxylate?
The CAS number of Phenylmethyl 6-(4-chlorophenyl)-1,2,3,4-tetrahydro-4-methyl-2-oxo-5-pyrimidinecarboxylate is 329923-16-2.
What is the molecular formula of Phenylmethyl 6-(4-chlorophenyl)-1,2,3,4-tetrahydro-4-methyl-2-oxo-5-pyrimidinecarboxylate?
The molecular formula of Phenylmethyl 6-(4-chlorophenyl)-1,2,3,4-tetrahydro-4-methyl-2-oxo-5-pyrimidinecarboxylate is C19H17ClN2O3.
What is the molecular weight of Phenylmethyl 6-(4-chlorophenyl)-1,2,3,4-tetrahydro-4-methyl-2-oxo-5-pyrimidinecarboxylate?
The molecular weight of Phenylmethyl 6-(4-chlorophenyl)-1,2,3,4-tetrahydro-4-methyl-2-oxo-5-pyrimidinecarboxylate is 356.09 g/mol.
Where can I buy Phenylmethyl 6-(4-chlorophenyl)-1,2,3,4-tetrahydro-4-methyl-2-oxo-5-pyrimidinecarboxylate?
You can request a quote for Phenylmethyl 6-(4-chlorophenyl)-1,2,3,4-tetrahydro-4-methyl-2-oxo-5-pyrimidinecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenylmethyl 6-(4-chlorophenyl)-1,2,3,4-tetrahydro-4-methyl-2-oxo-5-pyrimidinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Phenylmethyl 6-(4-chlorophenyl)-1,2,3,4-tetrahydro-4-methyl-2-oxo-5-pyrimidinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.