C19H22ClNO4
TL;DR: C19H22ClNO4 (CAS 1048947-14-3) is a chemical compound with molecular formula C19H22ClNO4 and molecular weight 363.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,3-benzodioxol-5-yl)-N-[(3-methoxy-4-prop-2-enoxyphenyl)methyl]methanamine;hydrochloride
Also Known As: N-(4-(allyloxy)-3-methoxybenzyl)-1-(benzo[d][1,3]dioxol-5-yl)methanamine hydrochloride, 1-(1,3-benzodioxol-5-yl)-N-[(3-methoxy-4-prop-2-enoxyphenyl)methyl]methanamine hydrochloride, 1-benzo[1,3]dioxol-5-yl-N-[(3-methoxy-4-prop-2-enoxy-phenyl)methyl]methanamine Hydrochloride
| Molecular Formula | C19H22ClNO4 |
|---|---|
| Molecular Weight | 363.12 g/mol |
| LogP | 3.7003 |
| Topological Polar Surface Area | 48.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 363.12375 |
| Heavy Atoms | 25 |
| Complexity | 720.5654 |
Chemical Identifiers
| CAS Number | 1048947-14-3 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)CNCC2=CC3=C(C=C2)OCO3)OCC=C.Cl |
Product Overview
C19H22ClNO4 (CAS 1048947-14-3), with molecular formula C19H22ClNO4 and molecular weight 363.12 g/mol. IUPAC: 1-(1,3-benzodioxol-5-yl)-N-[(3-methoxy-4-prop-2-enoxyphenyl)methyl]methanamine;hydrochloride.
Chemical Property Profile of C19H22ClNO4
Property Insights of C19H22ClNO4
The XLogP value of 3.7003 indicates that C19H22ClNO4 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.95 Ų, C19H22ClNO4 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C19H22ClNO4 has 1 hydrogen bond donor(s) and 5 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 C19H22ClNO4?
The CAS number of C19H22ClNO4 is 1048947-14-3.
What is the molecular formula of C19H22ClNO4?
The molecular formula of C19H22ClNO4 is C19H22ClNO4.
What is the molecular weight of C19H22ClNO4?
The molecular weight of C19H22ClNO4 is 363.12 g/mol.
Where can I buy C19H22ClNO4?
You can request a quote for C19H22ClNO4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C19H22ClNO4?
Yes, KEHONG BIO provides custom synthesis services for C19H22ClNO4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.