ChemDiv1_014613
TL;DR: ChemDiv1_014613 (CAS 477229-48-4) is a chemical compound with molecular formula C26H28ClN5O and molecular weight 461.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(3-chloro-4-methylphenyl)-N-(3-morpholin-4-ylpropyl)-5-phenylpyrrolo[2,3-d]pyrimidin-4-amine
Also Known As: ChemDiv1_014613, 7-(3-chloro-4-methylphenyl)-N-[3-(morpholin-4-yl)propyl]-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine, F0532-0375, 7-(3-chloro-4-methylphenyl)-N-(3-morpholinopropyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine, 7-(3-chloro-4-methylphenyl)-N-(3-morpholin-4-ylpropyl)-5-phenylpyrrolo[2,3-d]pyrimidin-4-amine
| Molecular Formula | C26H28ClN5O |
|---|---|
| Molecular Weight | 461.20 g/mol |
| LogP | 5.18352 |
| Topological Polar Surface Area | 55.21 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 461.19824 |
| Heavy Atoms | 33 |
| Complexity | 1234.4049 |
Chemical Identifiers
| CAS Number | 477229-48-4 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)N2C=C(C3=C(N=CN=C32)NCCCN4CCOCC4)C5=CC=CC=C5)Cl |
Product Overview
ChemDiv1_014613 (CAS 477229-48-4), with molecular formula C26H28ClN5O and molecular weight 461.20 g/mol. IUPAC: 7-(3-chloro-4-methylphenyl)-N-(3-morpholin-4-ylpropyl)-5-phenylpyrrolo[2,3-d]pyrimidin-4-amine.
Chemical Property Profile of ChemDiv1_014613
Property Insights of ChemDiv1_014613
The XLogP value of 5.18352 indicates that ChemDiv1_014613 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.21 Ų, ChemDiv1_014613 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_014613 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_014613?
The CAS number of ChemDiv1_014613 is 477229-48-4.
What is the molecular formula of ChemDiv1_014613?
The molecular formula of ChemDiv1_014613 is C26H28ClN5O.
What is the molecular weight of ChemDiv1_014613?
The molecular weight of ChemDiv1_014613 is 461.20 g/mol.
Where can I buy ChemDiv1_014613?
You can request a quote for ChemDiv1_014613 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_014613?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_014613 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.