ChemDiv1_000418
TL;DR: ChemDiv1_000418 (CAS 296263-00-8) is a chemical compound with molecular formula C15H11Cl2F5N2O3 and molecular weight 432.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,3,3,3-pentafluoropropyl 4-(3,4-dichlorophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: ChemDiv1_000418, BAS 00232720, 2,2,3,3,3-pentafluoropropyl 4-(3,4-dichlorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, 2,2,3,3,3-pentafluoropropyl 4-(3,4-dichlorophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate, 2,2,3,3,3-Pentafluoropropyl 4-(3,4-dichlorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
| Molecular Formula | C15H11Cl2F5N2O3 |
|---|---|
| Molecular Weight | 432.01 g/mol |
| LogP | 4.3621 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 432.00668 |
| Heavy Atoms | 27 |
| Complexity | 811.1324 |
Chemical Identifiers
| CAS Number | 296263-00-8 |
|---|---|
| SMILES | CC1=C(C(NC(=O)N1)C2=CC(=C(C=C2)Cl)Cl)C(=O)OCC(C(F)(F)F)(F)F |
Product Overview
ChemDiv1_000418 (CAS 296263-00-8), with molecular formula C15H11Cl2F5N2O3 and molecular weight 432.01 g/mol. IUPAC: 2,2,3,3,3-pentafluoropropyl 4-(3,4-dichlorophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of ChemDiv1_000418
Property Insights of ChemDiv1_000418
The XLogP value of 4.3621 indicates that ChemDiv1_000418 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 ChemDiv1_000418. Following Lipinski's Rule of Five, ChemDiv1_000418 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 ChemDiv1_000418?
The CAS number of ChemDiv1_000418 is 296263-00-8.
What is the molecular formula of ChemDiv1_000418?
The molecular formula of ChemDiv1_000418 is C15H11Cl2F5N2O3.
What is the molecular weight of ChemDiv1_000418?
The molecular weight of ChemDiv1_000418 is 432.01 g/mol.
Where can I buy ChemDiv1_000418?
You can request a quote for ChemDiv1_000418 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_000418?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_000418 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.