(1,3-Dioxaindan-5-yl)thiourea
TL;DR: (1,3-Dioxaindan-5-yl)thiourea (CAS 65069-55-8) is a chemical compound with molecular formula C8H8N2O2S and molecular weight 196.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-benzodioxol-5-ylthiourea
Also Known As: 1,3-benzodioxol-5-ylthiourea, 1-(3,4-Methylenedioxyphenyl)-2-thiourea, N-(1,3-benzodioxol-5-yl)thiourea, 1-(Benzo[d][1,3]dioxol-5-yl)thiourea, (2H-1,3-benzodioxol-5-yl)thiourea
| Molecular Formula | C8H8N2O2S |
|---|---|
| Molecular Weight | 196.03 g/mol |
| LogP | 1.0708 |
| Topological Polar Surface Area | 56.51 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 196.03065 |
| Heavy Atoms | 13 |
| Complexity | 353.9973 |
Chemical Identifiers
| CAS Number | 65069-55-8 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)NC(=S)N |
Product Overview
(1,3-Dioxaindan-5-yl)thiourea (CAS 65069-55-8), with molecular formula C8H8N2O2S and molecular weight 196.03 g/mol. IUPAC: 1,3-benzodioxol-5-ylthiourea.
Chemical Property Profile of (1,3-Dioxaindan-5-yl)thiourea
Property Insights of (1,3-Dioxaindan-5-yl)thiourea
The XLogP value of 1.0708 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1,3-Dioxaindan-5-yl)thiourea. With a topological polar surface area (TPSA) of 56.51 Ų, (1,3-Dioxaindan-5-yl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1,3-Dioxaindan-5-yl)thiourea 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 (1,3-Dioxaindan-5-yl)thiourea?
The CAS number of (1,3-Dioxaindan-5-yl)thiourea is 65069-55-8.
What is the molecular formula of (1,3-Dioxaindan-5-yl)thiourea?
The molecular formula of (1,3-Dioxaindan-5-yl)thiourea is C8H8N2O2S.
What is the molecular weight of (1,3-Dioxaindan-5-yl)thiourea?
The molecular weight of (1,3-Dioxaindan-5-yl)thiourea is 196.03 g/mol.
Where can I buy (1,3-Dioxaindan-5-yl)thiourea?
You can request a quote for (1,3-Dioxaindan-5-yl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1,3-Dioxaindan-5-yl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for (1,3-Dioxaindan-5-yl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.