RefChem:305609
TL;DR: RefChem:305609 (CAS 1162-96-5) is a chemical compound with molecular formula C19H24ClN3O and molecular weight 345.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,11-dimethyl-6-oxobenzo[b][1,4]benzodiazepin-5-yl)ethyl-dimethylazanium chloride
Also Known As: 5H-Dibenzo(b,e)(1,4)diazepin-11-one, 10,11-dihydro-5,8-dimethyl-10-(2-(dimethylamino)ethyl), hydrochloride, 2-(3,11-dimethyl-6-oxobenzo[b][1,4]benzodiazepin-5-yl)ethyl-dimethylazanium chloride, 11H-Dibenzo[b,e][1,4]diazepin-11-one, 10-[2-(dimethylamino)ethyl]-5,10-dihydro-5,8-dimethyl-, monohydrochloride, 5H-DIBENZO(b,e)(1,4)DIAZEPIN-11-ONE, 10,11-DIHYDRO-5,8-DIMETHYL-10-(2-(DIMETHYLA, RefChem:305609
| Molecular Formula | C19H24ClN3O |
|---|---|
| Molecular Weight | 345.16 g/mol |
| LogP | -1.13 |
| Topological Polar Surface Area | 28.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 345.1608 |
| Heavy Atoms | 24 |
| Complexity | 425.0 |
Chemical Identifiers
| CAS Number | 1162-96-5 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N(C3=CC=CC=C3C(=O)N2CC[NH+](C)C)C.[Cl-] |
| InChIKey | ZPSFYMHWJALEIJ-UHFFFAOYSA-N |
Product Overview
RefChem:305609 (CAS 1162-96-5), with molecular formula C19H24ClN3O and molecular weight 345.16 g/mol. IUPAC: 2-(3,11-dimethyl-6-oxobenzo[b][1,4]benzodiazepin-5-yl)ethyl-dimethylazanium chloride.
Chemical Property Profile of RefChem:305609
Property Insights of RefChem:305609
The XLogP value of -1.13 indicates that RefChem:305609 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 28.0 Ų, RefChem:305609 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:305609 has 1 hydrogen bond donor(s) and 3 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:305609?
The CAS number of RefChem:305609 is 1162-96-5.
What is the molecular formula of RefChem:305609?
The molecular formula of RefChem:305609 is C19H24ClN3O.
What is the molecular weight of RefChem:305609?
The molecular weight of RefChem:305609 is 345.16 g/mol.
Where can I buy RefChem:305609?
You can request a quote for RefChem:305609 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:305609?
Yes, KEHONG BIO provides custom synthesis services for RefChem:305609 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.