RefChem:1061434
TL;DR: RefChem:1061434 (CAS 105335-53-3) is a chemical compound with molecular formula C13H19ClN2O and molecular weight 254.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1S,2R)-2-(dimethylcarbamoyl)-2-phenylcyclopropyl]methylazanium chloride
Also Known As: (Z)-2-(Aminomethyl)-N,N-dimethyl-1-phenylcyclopropanecarboxamide hydrochloride, Cyclopropanecarboxamide, 2-(aminomethyl)-N,N-dimethyl-1-phenyl-, (Z)-, monohydrochloride, [(1S,2R)-2-(Dimethylcarbamoyl)-2-phenylcyclopropyl]methylazaniumchloride, [(1S,2R)-2-(dimethylcarbamoyl)-2-phenylcyclopropyl]methylazanium chloride, 2-(Aminomethyl)-N,N-dimethyl-1-phenylcyclopropane-1-carboxamide--hydrogen chloride (1/1)
| Molecular Formula | C13H19ClN2O |
|---|---|
| Molecular Weight | 254.12 g/mol |
| LogP | -2.72 |
| Topological Polar Surface Area | 48.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 254.11859 |
| Heavy Atoms | 17 |
| Complexity | 271.0 |
Chemical Identifiers
| CAS Number | 105335-53-3 |
|---|---|
| SMILES | CN(C)C(=O)[C@@]1(C[C@@H]1C[NH3+])C2=CC=CC=C2.[Cl-] |
| InChIKey | GIEDFGXZKMSAJZ-YLAFAASESA-N |
Product Overview
RefChem:1061434 (CAS 105335-53-3), with molecular formula C13H19ClN2O and molecular weight 254.12 g/mol. IUPAC: [(1S,2R)-2-(dimethylcarbamoyl)-2-phenylcyclopropyl]methylazanium chloride.
Chemical Property Profile of RefChem:1061434
Property Insights of RefChem:1061434
The XLogP value of -2.72 indicates that RefChem:1061434 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 48.0 Ų, RefChem:1061434 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1061434 has 1 hydrogen bond donor(s) and 2 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:1061434?
The CAS number of RefChem:1061434 is 105335-53-3.
What is the molecular formula of RefChem:1061434?
The molecular formula of RefChem:1061434 is C13H19ClN2O.
What is the molecular weight of RefChem:1061434?
The molecular weight of RefChem:1061434 is 254.12 g/mol.
Where can I buy RefChem:1061434?
You can request a quote for RefChem:1061434 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1061434?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1061434 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.