gp120-IN-1
TL;DR: gp120-IN-1 (CAS 5948-75-4) is a chemical compound with molecular formula C15H18N2O4S and molecular weight 322.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(4-hydroxy-3-methoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: gp120-IN-1, BAS 00381326, UPCMLD0ENAT5762053:001, J2.077.697H, F0896-0356
| Molecular Formula | C15H18N2O4S |
|---|---|
| Molecular Weight | 322.10 g/mol |
| LogP | 1.7567 |
| Topological Polar Surface Area | 79.82 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 322.09872 |
| Heavy Atoms | 22 |
| Complexity | 642.4297 |
Chemical Identifiers
| CAS Number | 5948-75-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC(=S)NC1C2=CC(=C(C=C2)O)OC)C |
Product Overview
gp120-IN-1 (CAS 5948-75-4), with molecular formula C15H18N2O4S and molecular weight 322.10 g/mol. IUPAC: ethyl 4-(4-hydroxy-3-methoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of gp120-IN-1
Property Insights of gp120-IN-1
The XLogP value of 1.7567 suggests moderate lipophilicity, balancing water solubility and membrane permeability for gp120-IN-1. The TPSA of 79.82 Ų falls within the moderate polarity range, balancing permeability and solubility for gp120-IN-1. Following Lipinski's Rule of Five, gp120-IN-1 has 3 hydrogen bond donor(s) and 5 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 gp120-IN-1?
The CAS number of gp120-IN-1 is 5948-75-4.
What is the molecular formula of gp120-IN-1?
The molecular formula of gp120-IN-1 is C15H18N2O4S.
What is the molecular weight of gp120-IN-1?
The molecular weight of gp120-IN-1 is 322.10 g/mol.
Where can I buy gp120-IN-1?
You can request a quote for gp120-IN-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for gp120-IN-1?
Yes, KEHONG BIO provides custom synthesis services for gp120-IN-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.