J2.656.169H
TL;DR: J2.656.169H (CAS 488709-96-2) is a chemical compound with molecular formula C16H19ClN2O3 and molecular weight 322.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl 4-(2-chlorophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: J2.656.169H, AB01331419-02, tert-butyl 4-(2-chlorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, tert-butyl 4-(2-chlorophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate, tert-butyl 6-(2-chlorophenyl)-2-hydroxy-4-methyl-1,6-dihydropyrimidine-5-carboxylate
| Molecular Formula | C16H19ClN2O3 |
|---|---|
| Molecular Weight | 322.11 g/mol |
| LogP | 3.3096 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 322.10843 |
| Heavy Atoms | 22 |
| Complexity | 647.03613 |
Chemical Identifiers
| CAS Number | 488709-96-2 |
|---|---|
| SMILES | CC1=C(C(NC(=O)N1)C2=CC=CC=C2Cl)C(=O)OC(C)(C)C |
Product Overview
J2.656.169H (CAS 488709-96-2), with molecular formula C16H19ClN2O3 and molecular weight 322.11 g/mol. IUPAC: tert-butyl 4-(2-chlorophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of J2.656.169H
Property Insights of J2.656.169H
The XLogP value of 3.3096 indicates that J2.656.169H 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 J2.656.169H. Following Lipinski's Rule of Five, J2.656.169H 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 J2.656.169H?
The CAS number of J2.656.169H is 488709-96-2.
What is the molecular formula of J2.656.169H?
The molecular formula of J2.656.169H is C16H19ClN2O3.
What is the molecular weight of J2.656.169H?
The molecular weight of J2.656.169H is 322.11 g/mol.
Where can I buy J2.656.169H?
You can request a quote for J2.656.169H directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for J2.656.169H?
Yes, KEHONG BIO provides custom synthesis services for J2.656.169H and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.