1-(1,3-Benzodioxol-5-yl)-3-[(4-methoxyphenyl)methyl]urea
TL;DR: 1-(1,3-Benzodioxol-5-yl)-3-[(4-methoxyphenyl)methyl]urea (CAS 894402-31-4) is a chemical compound with molecular formula C16H16N2O4 and molecular weight 300.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,3-benzodioxol-5-yl)-3-[(4-methoxyphenyl)methyl]urea
Also Known As: 1-(1,3-benzodioxol-5-yl)-3-(4-methoxybenzyl)urea, 1-(1,3-benzodioxol-5-yl)-3-[(4-methoxyphenyl)methyl]urea, 1-benzo[1,3]dioxol-5-yl-3-[(4-methoxyphenyl)methyl]urea, N-(1,3-BENZODIOXOL-5-YL)-N'-(4-METHOXYBENZYL)UREA, N-(2H-benzo[3,4-d]1,3-dioxolan-5-yl){[(4-methoxyphenyl)methyl]amino}carboxamid e
| Molecular Formula | C16H16N2O4 |
|---|---|
| Molecular Weight | 300.11 g/mol |
| LogP | 2.7456 |
| Topological Polar Surface Area | 68.82 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 300.111 |
| Heavy Atoms | 22 |
| Complexity | 670.34607 |
Chemical Identifiers
| CAS Number | 894402-31-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CNC(=O)NC2=CC3=C(C=C2)OCO3 |
Product Overview
1-(1,3-Benzodioxol-5-yl)-3-[(4-methoxyphenyl)methyl]urea (CAS 894402-31-4), with molecular formula C16H16N2O4 and molecular weight 300.11 g/mol. IUPAC: 1-(1,3-benzodioxol-5-yl)-3-[(4-methoxyphenyl)methyl]urea.
Chemical Property Profile of 1-(1,3-Benzodioxol-5-yl)-3-[(4-methoxyphenyl)methyl]urea
Property Insights of 1-(1,3-Benzodioxol-5-yl)-3-[(4-methoxyphenyl)methyl]urea
The XLogP value of 2.7456 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(1,3-Benzodioxol-5-yl)-3-[(4-methoxyphenyl)methyl]urea. The TPSA of 68.82 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(1,3-Benzodioxol-5-yl)-3-[(4-methoxyphenyl)methyl]urea. Following Lipinski's Rule of Five, 1-(1,3-Benzodioxol-5-yl)-3-[(4-methoxyphenyl)methyl]urea 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 1-(1,3-Benzodioxol-5-yl)-3-[(4-methoxyphenyl)methyl]urea?
The CAS number of 1-(1,3-Benzodioxol-5-yl)-3-[(4-methoxyphenyl)methyl]urea is 894402-31-4.
What is the molecular formula of 1-(1,3-Benzodioxol-5-yl)-3-[(4-methoxyphenyl)methyl]urea?
The molecular formula of 1-(1,3-Benzodioxol-5-yl)-3-[(4-methoxyphenyl)methyl]urea is C16H16N2O4.
What is the molecular weight of 1-(1,3-Benzodioxol-5-yl)-3-[(4-methoxyphenyl)methyl]urea?
The molecular weight of 1-(1,3-Benzodioxol-5-yl)-3-[(4-methoxyphenyl)methyl]urea is 300.11 g/mol.
Where can I buy 1-(1,3-Benzodioxol-5-yl)-3-[(4-methoxyphenyl)methyl]urea?
You can request a quote for 1-(1,3-Benzodioxol-5-yl)-3-[(4-methoxyphenyl)methyl]urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1,3-Benzodioxol-5-yl)-3-[(4-methoxyphenyl)methyl]urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(1,3-Benzodioxol-5-yl)-3-[(4-methoxyphenyl)methyl]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.