ChemDiv1_009282
TL;DR: ChemDiv1_009282 (CAS 421576-06-9) is a chemical compound with molecular formula C21H22ClN3O5 and molecular weight 431.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chlorophenyl)-6-methyl-2-oxo-4-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxamide
Also Known As: ChemDiv1_009282, BAS 01511194, N-(3-chlorophenyl)-6-methyl-2-oxo-4-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxamide, AB00099678-01, F1011-1869
| Molecular Formula | C21H22ClN3O5 |
|---|---|
| Molecular Weight | 431.12 g/mol |
| LogP | 3.6324 |
| Topological Polar Surface Area | 97.92 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 431.1248 |
| Heavy Atoms | 30 |
| Complexity | 996.4466 |
Chemical Identifiers
| CAS Number | 421576-06-9 |
|---|---|
| SMILES | CC1=C(C(NC(=O)N1)C2=CC(=C(C(=C2)OC)OC)OC)C(=O)NC3=CC(=CC=C3)Cl |
Product Overview
ChemDiv1_009282 (CAS 421576-06-9), with molecular formula C21H22ClN3O5 and molecular weight 431.12 g/mol. IUPAC: N-(3-chlorophenyl)-6-methyl-2-oxo-4-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxamide.
Chemical Property Profile of ChemDiv1_009282
Property Insights of ChemDiv1_009282
The XLogP value of 3.6324 indicates that ChemDiv1_009282 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.92 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_009282. Following Lipinski's Rule of Five, ChemDiv1_009282 has 3 hydrogen bond donor(s) and 5 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 ChemDiv1_009282?
The CAS number of ChemDiv1_009282 is 421576-06-9.
What is the molecular formula of ChemDiv1_009282?
The molecular formula of ChemDiv1_009282 is C21H22ClN3O5.
What is the molecular weight of ChemDiv1_009282?
The molecular weight of ChemDiv1_009282 is 431.12 g/mol.
Where can I buy ChemDiv1_009282?
You can request a quote for ChemDiv1_009282 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_009282?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_009282 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.