VU0080394-1
TL;DR: VU0080394-1 (CAS 477229-49-5) is a chemical compound with molecular formula C24H23ClN4O and molecular weight 418.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(3-chloro-4-methylphenyl)-N-(oxolan-2-ylmethyl)-5-phenylpyrrolo[2,3-d]pyrimidin-4-amine
Also Known As: VU0080394-1, F0532-0376, 7-(3-chloro-4-methylphenyl)-N-[(oxolan-2-yl)methyl]-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine, 7-(3-chloro-4-methylphenyl)-N-(oxolan-2-ylmethyl)-5-phenylpyrrolo[2,3-d]pyrimidin-4-amine, 7-(3-chloro-4-methylphenyl)-5-phenyl-N-((tetrahydrofuran-2-yl)methyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine
| Molecular Formula | C24H23ClN4O |
|---|---|
| Molecular Weight | 418.16 g/mol |
| LogP | 5.64022 |
| Topological Polar Surface Area | 51.97 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 418.15604 |
| Heavy Atoms | 30 |
| Complexity | 1182.7631 |
Chemical Identifiers
| CAS Number | 477229-49-5 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)N2C=C(C3=C(N=CN=C32)NCC4CCCO4)C5=CC=CC=C5)Cl |
Product Overview
VU0080394-1 (CAS 477229-49-5), with molecular formula C24H23ClN4O and molecular weight 418.16 g/mol. IUPAC: 7-(3-chloro-4-methylphenyl)-N-(oxolan-2-ylmethyl)-5-phenylpyrrolo[2,3-d]pyrimidin-4-amine.
Chemical Property Profile of VU0080394-1
Property Insights of VU0080394-1
The XLogP value of 5.64022 indicates that VU0080394-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.97 Ų, VU0080394-1 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, VU0080394-1 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 VU0080394-1?
The CAS number of VU0080394-1 is 477229-49-5.
What is the molecular formula of VU0080394-1?
The molecular formula of VU0080394-1 is C24H23ClN4O.
What is the molecular weight of VU0080394-1?
The molecular weight of VU0080394-1 is 418.16 g/mol.
Where can I buy VU0080394-1?
You can request a quote for VU0080394-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0080394-1?
Yes, KEHONG BIO provides custom synthesis services for VU0080394-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.