ChemDiv1_002048
TL;DR: ChemDiv1_002048 (CAS 329066-50-4) is a chemical compound with molecular formula C26H30N2O4 and molecular weight 434.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclohexylmethyl 6-methyl-2-oxo-4-(2-phenylmethoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: ChemDiv1_002048, BAS 00915986, A1903/0079916, cyclohexylmethyl 4-[2-(benzyloxy)phenyl]-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, cyclohexylmethyl 4-(2-(benzyloxy)phenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
| Molecular Formula | C26H30N2O4 |
|---|---|
| Molecular Weight | 434.22 g/mol |
| LogP | 5.017 |
| Topological Polar Surface Area | 76.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 434.22055 |
| Heavy Atoms | 32 |
| Complexity | 980.33124 |
Chemical Identifiers
| CAS Number | 329066-50-4 |
|---|---|
| SMILES | CC1=C(C(NC(=O)N1)C2=CC=CC=C2OCC3=CC=CC=C3)C(=O)OCC4CCCCC4 |
Product Overview
ChemDiv1_002048 (CAS 329066-50-4), with molecular formula C26H30N2O4 and molecular weight 434.22 g/mol. IUPAC: cyclohexylmethyl 6-methyl-2-oxo-4-(2-phenylmethoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of ChemDiv1_002048
Property Insights of ChemDiv1_002048
The XLogP value of 5.017 indicates that ChemDiv1_002048 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.66 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_002048. Following Lipinski's Rule of Five, ChemDiv1_002048 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_002048?
The CAS number of ChemDiv1_002048 is 329066-50-4.
What is the molecular formula of ChemDiv1_002048?
The molecular formula of ChemDiv1_002048 is C26H30N2O4.
What is the molecular weight of ChemDiv1_002048?
The molecular weight of ChemDiv1_002048 is 434.22 g/mol.
Where can I buy ChemDiv1_002048?
You can request a quote for ChemDiv1_002048 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_002048?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_002048 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.