RefChem:332102
TL;DR: RefChem:332102 (CAS 42438-03-9) is a chemical compound with molecular formula C20H35ClN2O3 and molecular weight 386.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl-[2-[(4-hexoxyphenyl)carbamoyloxy]propyl]azanium chloride
Also Known As: (4-(Hexyloxy)phenyl)carbamic acid 2-(diethylamino)-1-methylethyl ester hydrochloride, Carbanilic acid, p-hexyloxy-, 2-(diethylamino)-1-methylethyl ester, hydrochloride, Carbamic acid, (4-(hexyloxy)phenyl)-, 2-(diethylamino)-1-methylethyl ester, monohydrochloride, diethyl-[2-[(4-hexoxyphenyl)carbamoyloxy]propyl]azanium chloride, CARBAMIC ACID, (4-(HEXYLOXY)PHENYL)-, 2-(DIETHYLAMINO)-1-METHYLETHYL ESTER, MONO
| Molecular Formula | C20H35ClN2O3 |
|---|---|
| Molecular Weight | 386.23 g/mol |
| LogP | 0.51 |
| Topological Polar Surface Area | 52.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 13 |
| Exact Mass | 386.2336 |
| Heavy Atoms | 26 |
| Complexity | 340.0 |
Chemical Identifiers
| CAS Number | 42438-03-9 |
|---|---|
| SMILES | CCCCCCOC1=CC=C(C=C1)NC(=O)OC(C)C[NH+](CC)CC.[Cl-] |
| InChIKey | CJHOSQZUFNBTTG-UHFFFAOYSA-N |
Product Overview
RefChem:332102 (CAS 42438-03-9), with molecular formula C20H35ClN2O3 and molecular weight 386.23 g/mol. IUPAC: diethyl-[2-[(4-hexoxyphenyl)carbamoyloxy]propyl]azanium chloride.
Chemical Property Profile of RefChem:332102
Property Insights of RefChem:332102
The XLogP value of 0.51 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:332102. With a topological polar surface area (TPSA) of 52.0 Ų, RefChem:332102 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:332102 has 2 hydrogen bond donor(s) and 4 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:332102?
The CAS number of RefChem:332102 is 42438-03-9.
What is the molecular formula of RefChem:332102?
The molecular formula of RefChem:332102 is C20H35ClN2O3.
What is the molecular weight of RefChem:332102?
The molecular weight of RefChem:332102 is 386.23 g/mol.
Where can I buy RefChem:332102?
You can request a quote for RefChem:332102 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:332102?
Yes, KEHONG BIO provides custom synthesis services for RefChem:332102 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.