Diorthotolylguanidine hydrochloride
TL;DR: Diorthotolylguanidine hydrochloride (CAS 41130-39-6) is a chemical compound with molecular formula C15H18ClN3 and molecular weight 275.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[amino-(2-methylanilino)methylidene]-(2-methylphenyl)azanium chloride
Also Known As: Diorthotolylguanidine hydrochloride, N,N'-Di-o-tolylguanidine monohydrochloride, GUANIDINE, 1,3-DI-o-TOLYL-, HYDROCHLORIDE, [amino-(2-methylanilino)methylidene]-(2-methylphenyl)azanium chloride, EINECS 255-234-8
| Molecular Formula | C15H18ClN3 |
|---|---|
| Molecular Weight | 275.12 g/mol |
| LogP | -1.55 |
| Topological Polar Surface Area | 52.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 275.11893 |
| Heavy Atoms | 19 |
| Complexity | 259.0 |
Chemical Identifiers
| CAS Number | 41130-39-6 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=[NH+]C2=CC=CC=C2C)N.[Cl-] |
| InChIKey | NGAVOMFJBBCAMN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Diorthotolylguanidine hydrochloride (CAS 41130-39-6), with molecular formula C15H18ClN3 and molecular weight 275.12 g/mol. IUPAC: [amino-(2-methylanilino)methylidene]-(2-methylphenyl)azanium chloride.
Chemical Property Profile of Diorthotolylguanidine hydrochloride
Property Insights of Diorthotolylguanidine hydrochloride
The XLogP value of -1.55 indicates that Diorthotolylguanidine hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 52.0 Ų, Diorthotolylguanidine hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diorthotolylguanidine hydrochloride has 3 hydrogen bond donor(s) and 1 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 Diorthotolylguanidine hydrochloride?
The CAS number of Diorthotolylguanidine hydrochloride is 41130-39-6.
What is the molecular formula of Diorthotolylguanidine hydrochloride?
The molecular formula of Diorthotolylguanidine hydrochloride is C15H18ClN3.
What is the molecular weight of Diorthotolylguanidine hydrochloride?
The molecular weight of Diorthotolylguanidine hydrochloride is 275.12 g/mol.
Where can I buy Diorthotolylguanidine hydrochloride?
You can request a quote for Diorthotolylguanidine hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diorthotolylguanidine hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Diorthotolylguanidine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.