RefChem:305600
TL;DR: RefChem:305600 (CAS 78110-19-7) is a chemical compound with molecular formula C19H24ClN3OS and molecular weight 377.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl-[2-(11-methyl-2-methylsulfanyl-6-oxobenzo[b][1,4]benzodiazepin-5-yl)ethyl]azanium chloride
Also Known As: 5H-Dibenzo(b,e)(1,4)diazepin-11-one, 10,11-dihydro-10-(2-(dimethylamino)ethyl)-5-methyl-7-methylthio-, hydrochloride, dimethyl-[2-(11-methyl-2-methylsulfanyl-6-oxobenzo[b][1,4]benzodiazepin-5-yl)ethyl]azanium chloride, 5H-DIBENZO(b,e)(1,4)DIAZEPIN-11-ONE, 10,11-DIHYDRO-10-(2-(DIMETHYLAMINO)ETHYL)-5, 11H-Dibenzo[b,e][1,4]diazepin-11-one, 10-[2-(dimethylamino)ethyl]-5,10-dihydro-5-methyl-7-(methylthio)-, monohydrochloride, RefChem:305600
| Molecular Formula | C19H24ClN3OS |
|---|---|
| Molecular Weight | 377.13 g/mol |
| LogP | -0.71 |
| Topological Polar Surface Area | 53.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 377.13287 |
| Heavy Atoms | 25 |
| Complexity | 444.0 |
Chemical Identifiers
| CAS Number | 78110-19-7 |
|---|---|
| SMILES | CN1C2=CC=CC=C2C(=O)N(C3=C1C=C(C=C3)SC)CC[NH+](C)C.[Cl-] |
| InChIKey | YSNBGPBROFQBRJ-UHFFFAOYSA-N |
Product Overview
RefChem:305600 (CAS 78110-19-7), with molecular formula C19H24ClN3OS and molecular weight 377.13 g/mol. IUPAC: dimethyl-[2-(11-methyl-2-methylsulfanyl-6-oxobenzo[b][1,4]benzodiazepin-5-yl)ethyl]azanium chloride.
Chemical Property Profile of RefChem:305600
Property Insights of RefChem:305600
The XLogP value of -0.71 indicates that RefChem:305600 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 53.3 Ų, RefChem:305600 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:305600 has 1 hydrogen bond donor(s) and 4 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:305600?
The CAS number of RefChem:305600 is 78110-19-7.
What is the molecular formula of RefChem:305600?
The molecular formula of RefChem:305600 is C19H24ClN3OS.
What is the molecular weight of RefChem:305600?
The molecular weight of RefChem:305600 is 377.13 g/mol.
Where can I buy RefChem:305600?
You can request a quote for RefChem:305600 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:305600?
Yes, KEHONG BIO provides custom synthesis services for RefChem:305600 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.