Urea, 1,1-diallyl-3-(1,4-benzodioxan-2-ylmethyl)-3-methyl-
TL;DR: Urea, 1,1-diallyl-3-(1,4-benzodioxan-2-ylmethyl)-3-methyl- (CAS 13988-24-4) is a chemical compound with molecular formula C17H22N2O3 and molecular weight 302.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-methyl-3,3-bis(prop-2-enyl)urea
Also Known As: A 2275, 1,1-Diallyl-3-(1,4-benzodioxan-2-ylmethyl)-3-methylurea, 2-(N,N-Diallylcarbamylmethyl)aminomethyl-1,4-benzodioxan, Urea, 1,1-diallyl-3-(1,4-benzodioxan-2-ylmethyl)-3-methyl-, A-2275
| Molecular Formula | C17H22N2O3 |
|---|---|
| Molecular Weight | 302.16 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 42.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 302.16306 |
| Heavy Atoms | 22 |
| Complexity | 389.0 |
Chemical Identifiers
| CAS Number | 13988-24-4 |
|---|---|
| SMILES | CN(CC1COC2=CC=CC=C2O1)C(=O)N(CC=C)CC=C |
| InChIKey | SVQHPQRSZJSPEB-UHFFFAOYSA-N |
Product Overview
Urea, 1,1-diallyl-3-(1,4-benzodioxan-2-ylmethyl)-3-methyl- (CAS 13988-24-4), with molecular formula C17H22N2O3 and molecular weight 302.16 g/mol. IUPAC: 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-methyl-3,3-bis(prop-2-enyl)urea.
Chemical Property Profile of Urea, 1,1-diallyl-3-(1,4-benzodioxan-2-ylmethyl)-3-methyl-
Property Insights of Urea, 1,1-diallyl-3-(1,4-benzodioxan-2-ylmethyl)-3-methyl-
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Urea, 1,1-diallyl-3-(1,4-benzodioxan-2-ylmethyl)-3-methyl-. With a topological polar surface area (TPSA) of 42.0 Ų, Urea, 1,1-diallyl-3-(1,4-benzodioxan-2-ylmethyl)-3-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Urea, 1,1-diallyl-3-(1,4-benzodioxan-2-ylmethyl)-3-methyl- has 0 hydrogen bond donor(s) and 3 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 Urea, 1,1-diallyl-3-(1,4-benzodioxan-2-ylmethyl)-3-methyl-?
The CAS number of Urea, 1,1-diallyl-3-(1,4-benzodioxan-2-ylmethyl)-3-methyl- is 13988-24-4.
What is the molecular formula of Urea, 1,1-diallyl-3-(1,4-benzodioxan-2-ylmethyl)-3-methyl-?
The molecular formula of Urea, 1,1-diallyl-3-(1,4-benzodioxan-2-ylmethyl)-3-methyl- is C17H22N2O3.
What is the molecular weight of Urea, 1,1-diallyl-3-(1,4-benzodioxan-2-ylmethyl)-3-methyl-?
The molecular weight of Urea, 1,1-diallyl-3-(1,4-benzodioxan-2-ylmethyl)-3-methyl- is 302.16 g/mol.
Where can I buy Urea, 1,1-diallyl-3-(1,4-benzodioxan-2-ylmethyl)-3-methyl-?
You can request a quote for Urea, 1,1-diallyl-3-(1,4-benzodioxan-2-ylmethyl)-3-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, 1,1-diallyl-3-(1,4-benzodioxan-2-ylmethyl)-3-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Urea, 1,1-diallyl-3-(1,4-benzodioxan-2-ylmethyl)-3-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.