![1-(Benzo[d][1,3]dioxol-5-yl)-3-cyclohexylthiourea structure](/static/products/452/452941-45-6.png)
1-(Benzo[d][1,3]dioxol-5-yl)-3-cyclohexylthiourea
TL;DR: 1-(Benzo[d][1,3]dioxol-5-yl)-3-cyclohexylthiourea (CAS 452941-45-6) is a chemical compound with molecular formula C14H18N2O2S and molecular weight 278.11 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-cyclohexylthiourea
Also Known As: 1-(1,3-benzodioxol-5-yl)-3-cyclohexylthiourea, 1-(Benzo[d][1,3]dioxol-5-yl)-3-cyclohexylthiourea
| Molecular Formula | C14H18N2O2S |
|---|---|
| Molecular Weight | 278.11 g/mol |
| LogP | 3.0344 |
| Topological Polar Surface Area | 42.52 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 278.1089 |
| Heavy Atoms | 19 |
| Complexity | 472.51382 |
Chemical Identifiers
| CAS Number | 452941-45-6 |
|---|---|
| SMILES | C1CCC(CC1)NC(=S)NC2=CC3=C(C=C2)OCO3 |
Product Overview
1-(Benzo[d][1,3]dioxol-5-yl)-3-cyclohexylthiourea (CAS 452941-45-6), with molecular formula C14H18N2O2S and molecular weight 278.11 g/mol. IUPAC: 1-(1,3-benzodioxol-5-yl)-3-cyclohexylthiourea.
Chemical Property Profile of 1-(Benzo[d][1,3]dioxol-5-yl)-3-cyclohexylthiourea
Property Insights of 1-(Benzo[d][1,3]dioxol-5-yl)-3-cyclohexylthiourea
The XLogP value of 3.0344 indicates that 1-(Benzo[d][1,3]dioxol-5-yl)-3-cyclohexylthiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.52 Ų, 1-(Benzo[d][1,3]dioxol-5-yl)-3-cyclohexylthiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Benzo[d][1,3]dioxol-5-yl)-3-cyclohexylthiourea has 2 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 1-(Benzo[d][1,3]dioxol-5-yl)-3-cyclohexylthiourea?
The CAS number of 1-(Benzo[d][1,3]dioxol-5-yl)-3-cyclohexylthiourea is 452941-45-6.
What is the molecular formula of 1-(Benzo[d][1,3]dioxol-5-yl)-3-cyclohexylthiourea?
The molecular formula of 1-(Benzo[d][1,3]dioxol-5-yl)-3-cyclohexylthiourea is C14H18N2O2S.
What is the molecular weight of 1-(Benzo[d][1,3]dioxol-5-yl)-3-cyclohexylthiourea?
The molecular weight of 1-(Benzo[d][1,3]dioxol-5-yl)-3-cyclohexylthiourea is 278.11 g/mol.
Where can I buy 1-(Benzo[d][1,3]dioxol-5-yl)-3-cyclohexylthiourea?
You can request a quote for 1-(Benzo[d][1,3]dioxol-5-yl)-3-cyclohexylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Benzo[d][1,3]dioxol-5-yl)-3-cyclohexylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(Benzo[d][1,3]dioxol-5-yl)-3-cyclohexylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.