ChemDiv1_010174
TL;DR: ChemDiv1_010174 (CAS 312601-59-5) is a chemical compound with molecular formula C30H32FN3O6 and molecular weight 549.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2-methoxyethyl) 4-[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Also Known As: ChemDiv1_010174, BIM-0002385.P001, bis(2-methoxyethyl) 4-[3-(4-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate, 3,5-bis(2-methoxyethyl) 4-[3-(4-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate, bis(2-methoxyethyl) 4-(3-(4-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
| Molecular Formula | C30H32FN3O6 |
|---|---|
| Molecular Weight | 549.23 g/mol |
| LogP | 4.2924 |
| Topological Polar Surface Area | 100.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 11 |
| Exact Mass | 549.22754 |
| Heavy Atoms | 40 |
| Complexity | 1368.9556 |
Chemical Identifiers
| CAS Number | 312601-59-5 |
|---|---|
| SMILES | CC1=C(C(C(=C(N1)C)C(=O)OCCOC)C2=CN(N=C2C3=CC=C(C=C3)F)C4=CC=CC=C4)C(=O)OCCOC |
Product Overview
ChemDiv1_010174 (CAS 312601-59-5), with molecular formula C30H32FN3O6 and molecular weight 549.23 g/mol. IUPAC: bis(2-methoxyethyl) 4-[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate.
Chemical Property Profile of ChemDiv1_010174
Property Insights of ChemDiv1_010174
The XLogP value of 4.2924 indicates that ChemDiv1_010174 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.91 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_010174. Following Lipinski's Rule of Five, ChemDiv1_010174 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_010174?
The CAS number of ChemDiv1_010174 is 312601-59-5.
What is the molecular formula of ChemDiv1_010174?
The molecular formula of ChemDiv1_010174 is C30H32FN3O6.
What is the molecular weight of ChemDiv1_010174?
The molecular weight of ChemDiv1_010174 is 549.23 g/mol.
Where can I buy ChemDiv1_010174?
You can request a quote for ChemDiv1_010174 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_010174?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_010174 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.