ChemDiv3_003850
TL;DR: ChemDiv3_003850 (CAS 433703-21-0) is a chemical compound with molecular formula C24H22ClFN4OS and molecular weight 468.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-chlorophenyl)-4-[4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-1-yl]thieno[2,3-d]pyrimidine
Also Known As: ChemDiv3_003850, IDI1_021760, 5-(4-chlorophenyl)-4-(4-(3-fluoro-4-methoxybenzyl)piperazin-1-yl)thieno[2,3-d]pyrimidine, F1092-0397, BRD-K93796411-001-01-7
| Molecular Formula | C24H22ClFN4OS |
|---|---|
| Molecular Weight | 468.12 g/mol |
| LogP | 5.4816 |
| Topological Polar Surface Area | 41.49 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 468.11868 |
| Heavy Atoms | 32 |
| Complexity | 1238.7219 |
Chemical Identifiers
| CAS Number | 433703-21-0 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CN2CCN(CC2)C3=C4C(=CSC4=NC=N3)C5=CC=C(C=C5)Cl)F |
Product Overview
ChemDiv3_003850 (CAS 433703-21-0), with molecular formula C24H22ClFN4OS and molecular weight 468.12 g/mol. IUPAC: 5-(4-chlorophenyl)-4-[4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-1-yl]thieno[2,3-d]pyrimidine.
Chemical Property Profile of ChemDiv3_003850
Property Insights of ChemDiv3_003850
The XLogP value of 5.4816 indicates that ChemDiv3_003850 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.49 Ų, ChemDiv3_003850 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv3_003850 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv3_003850?
The CAS number of ChemDiv3_003850 is 433703-21-0.
What is the molecular formula of ChemDiv3_003850?
The molecular formula of ChemDiv3_003850 is C24H22ClFN4OS.
What is the molecular weight of ChemDiv3_003850?
The molecular weight of ChemDiv3_003850 is 468.12 g/mol.
Where can I buy ChemDiv3_003850?
You can request a quote for ChemDiv3_003850 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_003850?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_003850 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.