![5-Methoxy-2-(3-methoxypropyl)-11-nitro-1H-thioxantheno[2,1,9-def]isoquinoline-1,3(2H)-dione structure](/static/products/1801/18014-08-9.webp)
5-Methoxy-2-(3-methoxypropyl)-11-nitro-1H-thioxantheno[2,1,9-def]isoquinoline-1,3(2H)-dione
TL;DR: 5-Methoxy-2-(3-methoxypropyl)-11-nitro-1H-thioxantheno[2,1,9-def]isoquinoline-1,3(2H)-dione (CAS 18014-08-9) is a chemical compound with molecular formula C23H18N2O6S and molecular weight 450.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-Methoxy-2-(3-methoxypropyl)-11-nitro-1H-thioxantheno[2,1,9-def]isoquinoline-1,3(2H)-dione
10-methoxy-14-(3-methoxypropyl)-18-nitro-8-thia-14-azapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(18),2,4,6,9,11,16,19-octaene-13,15-dione
Also Known As: 1H-Thioxantheno[2,1,9-def]isoquinoline-1,3(2H)-dione, 5-methoxy-2-(3-methoxypropyl)-11-nitro-, 5-Methoxy-2-(3-methoxypropyl)-11-nitro-1H-thioxantheno[2,1,9-def]isoquinoline-1,3(2H)-dione, 5-Methoxy-2-(3-methoxypropyl)-11-nitro-1H-thioxantheno(2,1,9-def)isoquinoline-1,3(2H)-dione, 10-methoxy-14-(3-methoxypropyl)-18-nitro-8-thia-14-azapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(18),2,4,6,9,11,16,19-octaene-13,15-dione, 1H-Thioxantheno(2,1,9-def)isoquinoline-1,3(2H)-dione, 5-methoxy-2-(3-methoxypropyl)-11-nitro-
| Molecular Formula | C23H18N2O6S |
|---|---|
| Molecular Weight | 450.09 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 127.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 450.08856 |
| Heavy Atoms | 32 |
| Complexity | 774.0 |
Chemical Identifiers
| CAS Number | 18014-08-9 |
|---|---|
| SMILES | COCCCN1C(=O)C2=CC(=C3C4=CC=CC=C4SC5=C(C=C(C2=C35)C1=O)OC)[N+](=O)[O-] |
| InChIKey | YSDPVJADGZAOBX-UHFFFAOYSA-N |
Product Overview
5-Methoxy-2-(3-methoxypropyl)-11-nitro-1H-thioxantheno[2,1,9-def]isoquinoline-1,3(2H)-dione (CAS 18014-08-9), with molecular formula C23H18N2O6S and molecular weight 450.09 g/mol. IUPAC: 10-methoxy-14-(3-methoxypropyl)-18-nitro-8-thia-14-azapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(18),2,4,6,9,11,16,19-octaene-13,15-dione.
Chemical Property Profile of 5-Methoxy-2-(3-methoxypropyl)-11-nitro-1H-thioxantheno[2,1,9-def]isoquinoline-1,3(2H)-dione
Property Insights of 5-Methoxy-2-(3-methoxypropyl)-11-nitro-1H-thioxantheno[2,1,9-def]isoquinoline-1,3(2H)-dione
The XLogP value of 3.9 indicates that 5-Methoxy-2-(3-methoxypropyl)-11-nitro-1H-thioxantheno[2,1,9-def]isoquinoline-1,3(2H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 127.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Methoxy-2-(3-methoxypropyl)-11-nitro-1H-thioxantheno[2,1,9-def]isoquinoline-1,3(2H)-dione. Following Lipinski's Rule of Five, 5-Methoxy-2-(3-methoxypropyl)-11-nitro-1H-thioxantheno[2,1,9-def]isoquinoline-1,3(2H)-dione has 0 hydrogen bond donor(s) and 7 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 5-Methoxy-2-(3-methoxypropyl)-11-nitro-1H-thioxantheno[2,1,9-def]isoquinoline-1,3(2H)-dione?
The CAS number of 5-Methoxy-2-(3-methoxypropyl)-11-nitro-1H-thioxantheno[2,1,9-def]isoquinoline-1,3(2H)-dione is 18014-08-9.
What is the molecular formula of 5-Methoxy-2-(3-methoxypropyl)-11-nitro-1H-thioxantheno[2,1,9-def]isoquinoline-1,3(2H)-dione?
The molecular formula of 5-Methoxy-2-(3-methoxypropyl)-11-nitro-1H-thioxantheno[2,1,9-def]isoquinoline-1,3(2H)-dione is C23H18N2O6S.
What is the molecular weight of 5-Methoxy-2-(3-methoxypropyl)-11-nitro-1H-thioxantheno[2,1,9-def]isoquinoline-1,3(2H)-dione?
The molecular weight of 5-Methoxy-2-(3-methoxypropyl)-11-nitro-1H-thioxantheno[2,1,9-def]isoquinoline-1,3(2H)-dione is 450.09 g/mol.
Where can I buy 5-Methoxy-2-(3-methoxypropyl)-11-nitro-1H-thioxantheno[2,1,9-def]isoquinoline-1,3(2H)-dione?
You can request a quote for 5-Methoxy-2-(3-methoxypropyl)-11-nitro-1H-thioxantheno[2,1,9-def]isoquinoline-1,3(2H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Methoxy-2-(3-methoxypropyl)-11-nitro-1H-thioxantheno[2,1,9-def]isoquinoline-1,3(2H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-Methoxy-2-(3-methoxypropyl)-11-nitro-1H-thioxantheno[2,1,9-def]isoquinoline-1,3(2H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.