RefChem:103944
TL;DR: RefChem:103944 (CAS 99688-44-5) is a chemical compound with molecular formula C36H17N3O6 and molecular weight 587.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[(5,10-dioxonaphtho[2,3-f][1,3]benzoxazol-2-yl)amino]-13H-naphtho[2,3-c]acridine-5,8,14-trione
Also Known As: 7-[(5,10-dioxo-5,10-dihydroanthra[2,3-d][1,3]oxazol-2-yl)amino]naphtho[2,3-c]acridine-5,8,14(13h)-trione, 6-((5,10-Dihydro-5,10-dioxoanthra(2,3-d)oxazol-2-yl)amino)naphth(2,3-c)acridine-5,8,14(13H)-trione, 6-[(5,10-DIHYDRO-5,10-DIOXOANTHRA[2,3-D]OXAZOL-2-YL)AMINO]NAPHTH[2,3-C]ACRIDINE-5,8,14(13H)-TRIONE, 309-010-2, 7-[(5,10-dioxonaphtho[2,3-f][1,3]benzoxazol-2-yl)amino]-13H-naphtho[2,3-c]acridine-5,8,14-trione
| Molecular Formula | C36H17N3O6 |
|---|---|
| Molecular Weight | 587.11 g/mol |
| LogP | 7.1 |
| Topological Polar Surface Area | 135.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 587.11176 |
| Heavy Atoms | 45 |
| Complexity | 1300.0 |
Chemical Identifiers
| CAS Number | 99688-44-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C3=CC4=C(C=C3C2=O)OC(=N4)NC5=C6C(=C7C(=C5)C(=O)C8=CC=CC=C8C7=O)NC9=CC=CC=C9C6=O |
| InChIKey | AVPSQAUUKGDGHY-UHFFFAOYSA-N |
Product Overview
RefChem:103944 (CAS 99688-44-5), with molecular formula C36H17N3O6 and molecular weight 587.11 g/mol. IUPAC: 7-[(5,10-dioxonaphtho[2,3-f][1,3]benzoxazol-2-yl)amino]-13H-naphtho[2,3-c]acridine-5,8,14-trione.
Chemical Property Profile of RefChem:103944
Property Insights of RefChem:103944
The XLogP value of 7.1 indicates that RefChem:103944 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:103944. Following Lipinski's Rule of Five, RefChem:103944 has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:103944?
The CAS number of RefChem:103944 is 99688-44-5.
What is the molecular formula of RefChem:103944?
The molecular formula of RefChem:103944 is C36H17N3O6.
What is the molecular weight of RefChem:103944?
The molecular weight of RefChem:103944 is 587.11 g/mol.
Where can I buy RefChem:103944?
You can request a quote for RefChem:103944 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:103944?
Yes, KEHONG BIO provides custom synthesis services for RefChem:103944 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.