VU0605766-1
TL;DR: VU0605766-1 (CAS 874397-80-5) is a chemical compound with molecular formula C22H18ClNO6 and molecular weight 427.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[7-chloro-2-(3-hydroxypropyl)-3,9-dioxo-1H-chromeno[2,3-c]pyrrol-1-yl]benzoate
Also Known As: VU0605766-1, AO-022/42872420, F3226-2873, methyl 4-[7-chloro-2-(3-hydroxypropyl)-3,9-dioxo-1,2,3,9-tetrahydrochromeno[2,3-c]pyrrol-1-yl]benzoate, methyl 4-[7-chloro-2-(3-hydroxypropyl)-3,9-dioxo-1H-chromeno[2,3-c]pyrrol-1-yl]benzoate
| Molecular Formula | C22H18ClNO6 |
|---|---|
| Molecular Weight | 427.08 g/mol |
| LogP | 3.1606 |
| Topological Polar Surface Area | 97.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 427.08228 |
| Heavy Atoms | 30 |
| Complexity | 1200.7136 |
Chemical Identifiers
| CAS Number | 874397-80-5 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)C2C3=C(C(=O)N2CCCO)OC4=C(C3=O)C=C(C=C4)Cl |
Product Overview
VU0605766-1 (CAS 874397-80-5), with molecular formula C22H18ClNO6 and molecular weight 427.08 g/mol. IUPAC: methyl 4-[7-chloro-2-(3-hydroxypropyl)-3,9-dioxo-1H-chromeno[2,3-c]pyrrol-1-yl]benzoate.
Chemical Property Profile of VU0605766-1
Property Insights of VU0605766-1
The XLogP value of 3.1606 indicates that VU0605766-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.05 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0605766-1. Following Lipinski's Rule of Five, VU0605766-1 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of VU0605766-1?
The CAS number of VU0605766-1 is 874397-80-5.
What is the molecular formula of VU0605766-1?
The molecular formula of VU0605766-1 is C22H18ClNO6.
What is the molecular weight of VU0605766-1?
The molecular weight of VU0605766-1 is 427.08 g/mol.
Where can I buy VU0605766-1?
You can request a quote for VU0605766-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0605766-1?
Yes, KEHONG BIO provides custom synthesis services for VU0605766-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.