RefChem:1096682
TL;DR: RefChem:1096682 (CAS 1476-35-3) is a chemical compound with molecular formula C16H27ClN2O and molecular weight 298.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(diethylamino)-N-[(2,4-dimethylphenyl)methyl]propanamide;hydrochloride
Also Known As: 2-(Diethylamino)-N-(2,4-dimethylbenzyl)propionamide hydrochloride, alpha-Diethylamino-N-(2,4-dimethylbenzyl)propionamide hydrochloride, Propionamide, 2-(diethylamino)-N-(2,4-dimethylbenzyl)-, monohydrochloride, 2-(diethylamino)-N-[(2,4-dimethylphenyl)methyl]propanamide hydrochloride, 2-(Diethylamino)-N-[(2,4-dimethylphenyl)methyl]propanimidic acid--hydrogen chloride (1/1)
| Molecular Formula | C16H27ClN2O |
|---|---|
| Molecular Weight | 298.18 g/mol |
| LogP | 3.07174 |
| Topological Polar Surface Area | 32.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 298.18118 |
| Heavy Atoms | 20 |
| Complexity | 276.0 |
Chemical Identifiers
| CAS Number | 1476-35-3 |
|---|---|
| SMILES | CCN(CC)C(C)C(=O)NCC1=C(C=C(C=C1)C)C.Cl |
| InChIKey | BWQVXNCXUIQDLS-UHFFFAOYSA-N |
Product Overview
RefChem:1096682 (CAS 1476-35-3), with molecular formula C16H27ClN2O and molecular weight 298.18 g/mol. IUPAC: 2-(diethylamino)-N-[(2,4-dimethylphenyl)methyl]propanamide;hydrochloride.
Chemical Property Profile of RefChem:1096682
Property Insights of RefChem:1096682
The XLogP value of 3.07174 indicates that RefChem:1096682 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.3 Ų, RefChem:1096682 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1096682 has 2 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:1096682?
The CAS number of RefChem:1096682 is 1476-35-3.
What is the molecular formula of RefChem:1096682?
The molecular formula of RefChem:1096682 is C16H27ClN2O.
What is the molecular weight of RefChem:1096682?
The molecular weight of RefChem:1096682 is 298.18 g/mol.
Where can I buy RefChem:1096682?
You can request a quote for RefChem:1096682 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1096682?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1096682 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.