G856-1101
TL;DR: G856-1101 (CAS 536708-41-5) is a chemical compound with molecular formula C28H24N4O5S and molecular weight 528.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[3-(4-ethoxyphenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]acetamide
Also Known As: G856-1101, F0580-0594, N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[3-(4-ethoxyphenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]acetamide, N-(2,3-DIHYDRO-1,4-BENZODIOXIN-6-YL)-2-{[3-(4-ETHOXYPHENYL)-4-OXO-3H,4H,5H-PYRIMIDO[5,4-B]INDOL-2-YL]SULFANYL}ACETAMIDE, N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[3-(4-ethoxyphenyl)-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl]thio}acetamide
| Molecular Formula | C28H24N4O5S |
|---|---|
| Molecular Weight | 528.15 g/mol |
| LogP | 4.7677 |
| Topological Polar Surface Area | 107.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 528.1467 |
| Heavy Atoms | 38 |
| Complexity | 1711.073 |
Chemical Identifiers
| CAS Number | 536708-41-5 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4N3)N=C2SCC(=O)NC5=CC6=C(C=C5)OCCO6 |
Product Overview
G856-1101 (CAS 536708-41-5), with molecular formula C28H24N4O5S and molecular weight 528.15 g/mol. IUPAC: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[3-(4-ethoxyphenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]acetamide.
Chemical Property Profile of G856-1101
Property Insights of G856-1101
The XLogP value of 4.7677 indicates that G856-1101 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.47 Ų falls within the moderate polarity range, balancing permeability and solubility for G856-1101. Following Lipinski's Rule of Five, G856-1101 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of G856-1101?
The CAS number of G856-1101 is 536708-41-5.
What is the molecular formula of G856-1101?
The molecular formula of G856-1101 is C28H24N4O5S.
What is the molecular weight of G856-1101?
The molecular weight of G856-1101 is 528.15 g/mol.
Where can I buy G856-1101?
You can request a quote for G856-1101 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for G856-1101?
Yes, KEHONG BIO provides custom synthesis services for G856-1101 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.