LIQ 4
TL;DR: LIQ 4 (CAS 6624-01-7) is a chemical compound with molecular formula C30H31N5O6 and molecular weight 557.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[9-[(4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]amino]-7,12-dimethyl-1,2,3,4-tetrahydrobenzo[a]anthracene-2,3,4-triol
Also Known As: LIQ 4, 2'-deoxy-n-(2,3,4-trihydroxy-7,12-dimethyl-1,2,3,4-tetrahydrotetraphen-1-yl)adenosine, 1-[[9-[(4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]amino]-7,12-dimethyl-1,2,3,4-tetrahydrobenzo[a]anthracene-2,3,4-triol
| Molecular Formula | C30H31N5O6 |
|---|---|
| Molecular Weight | 557.23 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 166.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 557.2274 |
| Heavy Atoms | 41 |
| Complexity | 934.0 |
Chemical Identifiers
| CAS Number | 6624-01-7 |
|---|---|
| SMILES | CC1=C2C=CC3=C(C2=C(C4=CC=CC=C14)C)C(C(C(C3O)O)O)NC5=C6C(=NC=N5)N(C=N6)C7C[C@@H]([C@H](O7)CO)O |
| InChIKey | MCZONDZGROJBST-WLYWPXNTSA-N |
Product Overview
LIQ 4 (CAS 6624-01-7), with molecular formula C30H31N5O6 and molecular weight 557.23 g/mol. IUPAC: 1-[[9-[(4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]amino]-7,12-dimethyl-1,2,3,4-tetrahydrobenzo[a]anthracene-2,3,4-triol.
Chemical Property Profile of LIQ 4
Property Insights of LIQ 4
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for LIQ 4. The TPSA of 166.0 Ų indicates high polarity, suggesting LIQ 4 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, LIQ 4 has 6 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of LIQ 4?
The CAS number of LIQ 4 is 6624-01-7.
What is the molecular formula of LIQ 4?
The molecular formula of LIQ 4 is C30H31N5O6.
What is the molecular weight of LIQ 4?
The molecular weight of LIQ 4 is 557.23 g/mol.
Where can I buy LIQ 4?
You can request a quote for LIQ 4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for LIQ 4?
Yes, KEHONG BIO provides custom synthesis services for LIQ 4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.