ksc-8-49
TL;DR: ksc-8-49 (CAS 700856-28-6) is a chemical compound with molecular formula C27H29N3O4S and molecular weight 491.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(4-morpholin-4-ylsulfonylphenyl)benzamide
Also Known As: ksc-8-49, ksc-8-49-110428, KUC104268N-02, 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(4-morpholin-4-ylsulfonylphenyl)benzamide, 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[4-(4-morpholinylsulfonyl)phenyl]benzamide
| Molecular Formula | C27H29N3O4S |
|---|---|
| Molecular Weight | 491.19 g/mol |
| LogP | 3.5181 |
| Topological Polar Surface Area | 78.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 491.18787 |
| Heavy Atoms | 35 |
| Complexity | 1284.7615 |
Chemical Identifiers
| CAS Number | 700856-28-6 |
|---|---|
| SMILES | C1CN(CC2=CC=CC=C21)CC3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)S(=O)(=O)N5CCOCC5 |
Product Overview
ksc-8-49 (CAS 700856-28-6), with molecular formula C27H29N3O4S and molecular weight 491.19 g/mol. IUPAC: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(4-morpholin-4-ylsulfonylphenyl)benzamide.
Chemical Property Profile of ksc-8-49
Property Insights of ksc-8-49
The XLogP value of 3.5181 indicates that ksc-8-49 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.95 Ų falls within the moderate polarity range, balancing permeability and solubility for ksc-8-49. Following Lipinski's Rule of Five, ksc-8-49 has 1 hydrogen bond donor(s) and 5 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 ksc-8-49?
The CAS number of ksc-8-49 is 700856-28-6.
What is the molecular formula of ksc-8-49?
The molecular formula of ksc-8-49 is C27H29N3O4S.
What is the molecular weight of ksc-8-49?
The molecular weight of ksc-8-49 is 491.19 g/mol.
Where can I buy ksc-8-49?
You can request a quote for ksc-8-49 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ksc-8-49?
Yes, KEHONG BIO provides custom synthesis services for ksc-8-49 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.