RefChem:563853
TL;DR: RefChem:563853 (CAS 65294-00-0) is a chemical compound with molecular formula C28H28ClN3O3S and molecular weight 521.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[6-chloro-8-[4-(diethylamino)-2-methylphenyl]imino-5-oxonaphthalen-1-yl]-4-methylbenzenesulfonamide
Also Known As: Benzenesulfonamide, N-(6-chloro-8-((4-(diethylamino)-2-methylphenyl)imino)-5,8-dihydro-5-oxo-1-naphthalenyl)-4-methyl-, 2-(dimethylamino)-1-phenanthren-2-ylethanol,hydrochloride, Benzenesulfonamide, N-[6-chloro-8-[[4-(diethylamino)-2-methylphenyl]imino]-5,8-dihydro-5-oxo-1-naphthalenyl]-4-methyl-, 2-(dimethylamino)-1-(phenanthren-2-yl)ethanol hydrochloride(1:1), N-(6-chloro-8-{[4-(diethylamino)-2-methylphenyl]imino}-5-oxo-5,8-dihydronaphthalen-1-yl)-4-methylbenzene-1-sulfonamide
| Molecular Formula | C28H28ClN3O3S |
|---|---|
| Molecular Weight | 521.15 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 87.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 521.154 |
| Heavy Atoms | 36 |
| Complexity | 948.0 |
Chemical Identifiers
| CAS Number | 65294-00-0 |
|---|---|
| SMILES | CCN(CC)C1=CC(=C(C=C1)N=C2C=C(C(=O)C3=C2C(=CC=C3)NS(=O)(=O)C4=CC=C(C=C4)C)Cl)C |
| InChIKey | LNCSEBZJLNBBQR-UHFFFAOYSA-N |
Product Overview
RefChem:563853 (CAS 65294-00-0), with molecular formula C28H28ClN3O3S and molecular weight 521.15 g/mol. IUPAC: N-[6-chloro-8-[4-(diethylamino)-2-methylphenyl]imino-5-oxonaphthalen-1-yl]-4-methylbenzenesulfonamide.
Chemical Property Profile of RefChem:563853
Property Insights of RefChem:563853
The XLogP value of 6.2 indicates that RefChem:563853 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.2 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:563853. Following Lipinski's Rule of Five, RefChem:563853 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:563853?
The CAS number of RefChem:563853 is 65294-00-0.
What is the molecular formula of RefChem:563853?
The molecular formula of RefChem:563853 is C28H28ClN3O3S.
What is the molecular weight of RefChem:563853?
The molecular weight of RefChem:563853 is 521.15 g/mol.
Where can I buy RefChem:563853?
You can request a quote for RefChem:563853 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:563853?
Yes, KEHONG BIO provides custom synthesis services for RefChem:563853 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.