ChemDiv1_014443
TL;DR: ChemDiv1_014443 (CAS 477231-85-9) is a chemical compound with molecular formula C24H18BrN5 and molecular weight 455.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(4-bromophenyl)-5-phenyl-N-(pyridin-3-ylmethyl)pyrrolo[2,3-d]pyrimidin-4-amine
Also Known As: ChemDiv1_014443, 7-(4-bromophenyl)-5-phenyl-N-(pyridin-3-ylmethyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine, F0532-0652, 7-(4-bromophenyl)-5-phenyl-N-(pyridin-3-ylmethyl)pyrrolo[2,3-d]pyrimidin-4-amine, 7-(4-bromophenyl)-5-phenyl-N-[(pyridin-3-yl)methyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine
| Molecular Formula | C24H18BrN5 |
|---|---|
| Molecular Weight | 455.07 g/mol |
| LogP | 5.8571 |
| Topological Polar Surface Area | 55.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 455.07455 |
| Heavy Atoms | 30 |
| Complexity | 1282.2639 |
Chemical Identifiers
| CAS Number | 477231-85-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CN(C3=NC=NC(=C23)NCC4=CN=CC=C4)C5=CC=C(C=C5)Br |
Product Overview
ChemDiv1_014443 (CAS 477231-85-9), with molecular formula C24H18BrN5 and molecular weight 455.07 g/mol. IUPAC: 7-(4-bromophenyl)-5-phenyl-N-(pyridin-3-ylmethyl)pyrrolo[2,3-d]pyrimidin-4-amine.
Chemical Property Profile of ChemDiv1_014443
Property Insights of ChemDiv1_014443
The XLogP value of 5.8571 indicates that ChemDiv1_014443 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.63 Ų, ChemDiv1_014443 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_014443 has 1 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_014443?
The CAS number of ChemDiv1_014443 is 477231-85-9.
What is the molecular formula of ChemDiv1_014443?
The molecular formula of ChemDiv1_014443 is C24H18BrN5.
What is the molecular weight of ChemDiv1_014443?
The molecular weight of ChemDiv1_014443 is 455.07 g/mol.
Where can I buy ChemDiv1_014443?
You can request a quote for ChemDiv1_014443 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_014443?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_014443 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.