RP 45906
TL;DR: RP 45906 (CAS 110672-00-9) is a chemical compound with molecular formula C20H20ClN5O4S2 and molecular weight 493.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[6-(7-chloro-1,8-naphthyridin-2-yl)-5-oxo-3,7-dihydro-2H-[1,4]dithiino[2,3-c]pyrrol-7-yl] 4-methyl-4-oxidopiperazin-4-ium-1-carboxylate
Also Known As: Suriclone N-oxide, RP 45906, [6-(7-chloro-1,8-naphthyridin-2-yl)-5-oxo-3,7-dihydro-2H-[1,4]dithiino[2,3-c]pyrrol-7-yl] 4-methyl-4-oxidopiperazin-4-ium-1-carboxylate, 6-(7-Chloro-1,8-naphthyridin-2-yl)-2,3,6,7-tetrahydro-7-oxo-5H-1,4-dithiino(2,3-e)pyrrol-5-yl 4-methyl-1-piperazinecarboxylate 4-oxide, 1-Piperazinecarboxylic acid, 4-methyl-, 6-(7-chloro-1,8-naphthyridin-2-yl)-2,3,6,7-tetrahydro-7-oxo-5H-1,4-dithiino(2,3-e)pyrrol-5-yl ester, 4-oxide
| Molecular Formula | C20H20ClN5O4S2 |
|---|---|
| Molecular Weight | 493.06 g/mol |
| LogP | 3.0441 |
| Topological Polar Surface Area | 98.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 493.0645 |
| Heavy Atoms | 32 |
| Complexity | 1134.1704 |
Chemical Identifiers
| CAS Number | 110672-00-9 |
|---|---|
| SMILES | C[N+]1(CCN(CC1)C(=O)OC2C3=C(C(=O)N2C4=NC5=C(C=C4)C=CC(=N5)Cl)SCCS3)[O-] |
Product Overview
RP 45906 (CAS 110672-00-9), with molecular formula C20H20ClN5O4S2 and molecular weight 493.06 g/mol. IUPAC: [6-(7-chloro-1,8-naphthyridin-2-yl)-5-oxo-3,7-dihydro-2H-[1,4]dithiino[2,3-c]pyrrol-7-yl] 4-methyl-4-oxidopiperazin-4-ium-1-carboxylate.
Chemical Property Profile of RP 45906
Property Insights of RP 45906
The XLogP value of 3.0441 indicates that RP 45906 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.69 Ų falls within the moderate polarity range, balancing permeability and solubility for RP 45906. Following Lipinski's Rule of Five, RP 45906 has 0 hydrogen bond donor(s) and 8 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 RP 45906?
The CAS number of RP 45906 is 110672-00-9.
What is the molecular formula of RP 45906?
The molecular formula of RP 45906 is C20H20ClN5O4S2.
What is the molecular weight of RP 45906?
The molecular weight of RP 45906 is 493.06 g/mol.
Where can I buy RP 45906?
You can request a quote for RP 45906 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RP 45906?
Yes, KEHONG BIO provides custom synthesis services for RP 45906 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.