Benz(b)acridin-12-amine, N-(3-((2-chloroethyl)thio)propyl)-, hydrochloride
TL;DR: Benz(b)acridin-12-amine, N-(3-((2-chloroethyl)thio)propyl)-, hydrochloride (CAS 38915-56-9) is a chemical compound with molecular formula C22H22Cl2N2S and molecular weight 416.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzo[b]acridin-12-yl-[3-(2-chloroethylsulfanyl)propyl]azanium chloride
Also Known As: ICR 424, 12-((3-((2-Chloroethyl)thio)propyl)amino)benz(b)acridine hydrochloride, Benz(b)acridine, 12-((3-((2-chloroethyl)thio)propyl)amino)-, hydrochloride, BENZ(b)ACRIDIN-12-AMINE, N-(3-((2-CHLOROETHYL)THIO)PROPYL)-, HYDROCHLORIDE, benzo[b]acridin-12-yl-[3-(2-chloroethylsulfanyl)propyl]azanium chloride
| Molecular Formula | C22H22Cl2N2S |
|---|---|
| Molecular Weight | 416.09 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 54.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 416.08807 |
| Heavy Atoms | 27 |
| Complexity | 434.0 |
Chemical Identifiers
| CAS Number | 38915-56-9 |
|---|---|
| SMILES | C1=CC=C2C=C3C(=CC2=C1)C(=C4C=CC=CC4=N3)[NH2+]CCCSCCCl.[Cl-] |
| InChIKey | MCJIDILBDIXVPP-UHFFFAOYSA-N |
Product Overview
Benz(b)acridin-12-amine, N-(3-((2-chloroethyl)thio)propyl)-, hydrochloride (CAS 38915-56-9), with molecular formula C22H22Cl2N2S and molecular weight 416.09 g/mol. IUPAC: benzo[b]acridin-12-yl-[3-(2-chloroethylsulfanyl)propyl]azanium chloride.
Chemical Property Profile of Benz(b)acridin-12-amine, N-(3-((2-chloroethyl)thio)propyl)-, hydrochloride
Property Insights of Benz(b)acridin-12-amine, N-(3-((2-chloroethyl)thio)propyl)-, hydrochloride
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benz(b)acridin-12-amine, N-(3-((2-chloroethyl)thio)propyl)-, hydrochloride. With a topological polar surface area (TPSA) of 54.8 Ų, Benz(b)acridin-12-amine, N-(3-((2-chloroethyl)thio)propyl)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benz(b)acridin-12-amine, N-(3-((2-chloroethyl)thio)propyl)-, hydrochloride 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 Benz(b)acridin-12-amine, N-(3-((2-chloroethyl)thio)propyl)-, hydrochloride?
The CAS number of Benz(b)acridin-12-amine, N-(3-((2-chloroethyl)thio)propyl)-, hydrochloride is 38915-56-9.
What is the molecular formula of Benz(b)acridin-12-amine, N-(3-((2-chloroethyl)thio)propyl)-, hydrochloride?
The molecular formula of Benz(b)acridin-12-amine, N-(3-((2-chloroethyl)thio)propyl)-, hydrochloride is C22H22Cl2N2S.
What is the molecular weight of Benz(b)acridin-12-amine, N-(3-((2-chloroethyl)thio)propyl)-, hydrochloride?
The molecular weight of Benz(b)acridin-12-amine, N-(3-((2-chloroethyl)thio)propyl)-, hydrochloride is 416.09 g/mol.
Where can I buy Benz(b)acridin-12-amine, N-(3-((2-chloroethyl)thio)propyl)-, hydrochloride?
You can request a quote for Benz(b)acridin-12-amine, N-(3-((2-chloroethyl)thio)propyl)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benz(b)acridin-12-amine, N-(3-((2-chloroethyl)thio)propyl)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Benz(b)acridin-12-amine, N-(3-((2-chloroethyl)thio)propyl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.