1-(2,3-Dichlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea
TL;DR: 1-(2,3-Dichlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea (CAS 701948-39-2) is a chemical compound with molecular formula C15H12Cl2N2O2S and molecular weight 354.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,3-dichlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea
Also Known As: 1-(2,3-dichlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea, (2H,3H-benzo[3,4-e]1,4-dioxan-6-ylamino)[(2,3-dichlorophenyl)amino]methane-1-t hione
| Molecular Formula | C15H12Cl2N2O2S |
|---|---|
| Molecular Weight | 354.00 g/mol |
| LogP | 4.5735 |
| Topological Polar Surface Area | 42.52 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 353.99966 |
| Heavy Atoms | 22 |
| Complexity | 724.6838 |
Chemical Identifiers
| CAS Number | 701948-39-2 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)NC(=S)NC3=C(C(=CC=C3)Cl)Cl |
Product Overview
1-(2,3-Dichlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea (CAS 701948-39-2), with molecular formula C15H12Cl2N2O2S and molecular weight 354.00 g/mol. IUPAC: 1-(2,3-dichlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea.
Chemical Property Profile of 1-(2,3-Dichlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea
Property Insights of 1-(2,3-Dichlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea
The XLogP value of 4.5735 indicates that 1-(2,3-Dichlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)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, 1-(2,3-Dichlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2,3-Dichlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-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-(2,3-Dichlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea?
The CAS number of 1-(2,3-Dichlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea is 701948-39-2.
What is the molecular formula of 1-(2,3-Dichlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea?
The molecular formula of 1-(2,3-Dichlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea is C15H12Cl2N2O2S.
What is the molecular weight of 1-(2,3-Dichlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea?
The molecular weight of 1-(2,3-Dichlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea is 354.00 g/mol.
Where can I buy 1-(2,3-Dichlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea?
You can request a quote for 1-(2,3-Dichlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-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-(2,3-Dichlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,3-Dichlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.