N-(4-bromophenyl)-N'-(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)thiourea
TL;DR: N-(4-bromophenyl)-N'-(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)thiourea (CAS 356573-45-0) is a chemical compound with molecular formula C16H15BrN2O2S and molecular weight 378.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-bromophenyl)-3-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)thiourea
Also Known As: N-(4-bromophenyl)-N'-(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)thiourea, 1-(4-bromophenyl)-3-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)thiourea, 1-(4-bromophenyl)-3-(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)thiourea
| Molecular Formula | C16H15BrN2O2S |
|---|---|
| Molecular Weight | 378.00 g/mol |
| LogP | 3.5755 |
| Topological Polar Surface Area | 42.52 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 378.00375 |
| Heavy Atoms | 22 |
| Complexity | 663.4503 |
Chemical Identifiers
| CAS Number | 356573-45-0 |
|---|---|
| SMILES | C1C(OC2=CC=CC=C2O1)CNC(=S)NC3=CC=C(C=C3)Br |
Product Overview
N-(4-bromophenyl)-N'-(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)thiourea (CAS 356573-45-0), with molecular formula C16H15BrN2O2S and molecular weight 378.00 g/mol. IUPAC: 1-(4-bromophenyl)-3-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)thiourea.
Chemical Property Profile of N-(4-bromophenyl)-N'-(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)thiourea
Property Insights of N-(4-bromophenyl)-N'-(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)thiourea
The XLogP value of 3.5755 indicates that N-(4-bromophenyl)-N'-(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.52 Ų, N-(4-bromophenyl)-N'-(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-bromophenyl)-N'-(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)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 N-(4-bromophenyl)-N'-(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)thiourea?
The CAS number of N-(4-bromophenyl)-N'-(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)thiourea is 356573-45-0.
What is the molecular formula of N-(4-bromophenyl)-N'-(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)thiourea?
The molecular formula of N-(4-bromophenyl)-N'-(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)thiourea is C16H15BrN2O2S.
What is the molecular weight of N-(4-bromophenyl)-N'-(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)thiourea?
The molecular weight of N-(4-bromophenyl)-N'-(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)thiourea is 378.00 g/mol.
Where can I buy N-(4-bromophenyl)-N'-(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)thiourea?
You can request a quote for N-(4-bromophenyl)-N'-(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-bromophenyl)-N'-(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for N-(4-bromophenyl)-N'-(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.