RefChem:438841
TL;DR: RefChem:438841 (CAS 68856-25-7) is a chemical compound with molecular formula C22H21N3O5 and molecular weight 407.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,11-diamino-2-(3-propan-2-yloxypropyl)naphtho[2,3-f]isoindole-1,3,5,10-tetrone
Also Known As: 1H-Naphth(2,3-f)isoindole-1,3,5,10(2H)-tetrone, 4,11-diamino-2-(3-(1-methylethoxy)propyl)-, 1H-Naphth[2,3-f]isoindole-1,3,5,10(2H)-tetrone, 4,11-diamino-2-[3-(1-methylethoxy)propyl]-, 1,4-Diamino-N-(3-isopropoxypropyl)anthraquinone-2,3-dicarboximide, 4,11-Diamine-2-[3-(1-methylethoxy)propyl]-1H-naphth[2,3-f]isoindole-1,3,5,10(2H)-tetrone, 4,11-Diamino-2-[3-(1-methylethoxy)propyl]-1H-naphth[2,3-f]isoindole-1,3,5,10(2H)-tetrone
| Molecular Formula | C22H21N3O5 |
|---|---|
| Molecular Weight | 407.15 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 133.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 407.14813 |
| Heavy Atoms | 30 |
| Complexity | 699.0 |
Chemical Identifiers
| CAS Number | 68856-25-7 |
|---|---|
| SMILES | CC(C)OCCCN1C(=O)C2=C(C3=C(C(=C2C1=O)N)C(=O)C4=CC=CC=C4C3=O)N |
| InChIKey | CLWTUYRFIABBIN-UHFFFAOYSA-N |
Product Overview
RefChem:438841 (CAS 68856-25-7), with molecular formula C22H21N3O5 and molecular weight 407.15 g/mol. IUPAC: 4,11-diamino-2-(3-propan-2-yloxypropyl)naphtho[2,3-f]isoindole-1,3,5,10-tetrone.
Chemical Property Profile of RefChem:438841
Property Insights of RefChem:438841
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:438841. The TPSA of 133.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:438841. Following Lipinski's Rule of Five, RefChem:438841 has 2 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 RefChem:438841?
The CAS number of RefChem:438841 is 68856-25-7.
What is the molecular formula of RefChem:438841?
The molecular formula of RefChem:438841 is C22H21N3O5.
What is the molecular weight of RefChem:438841?
The molecular weight of RefChem:438841 is 407.15 g/mol.
Where can I buy RefChem:438841?
You can request a quote for RefChem:438841 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:438841?
Yes, KEHONG BIO provides custom synthesis services for RefChem:438841 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.