N-(2,4-difluorophenyl)-N'-(2-thienylcarbonyl)thiourea
TL;DR: N-(2,4-difluorophenyl)-N'-(2-thienylcarbonyl)thiourea (CAS 900769-45-1) is a chemical compound with molecular formula C12H8F2N2OS2 and molecular weight 298.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2,4-difluorophenyl)carbamothioyl]thiophene-2-carboxamide
Also Known As: 1-(2,4-difluorophenyl)-3-(thiophene-2-carbonyl)thiourea, N-(2,4-difluorophenyl)-N'-(2-thienylcarbonyl)thiourea, N-[(2,4-difluorophenyl)carbamothioyl]thiophene-2-carboxamide, N-[(2,4-difluorophenyl)thiocarbamoyl]thiophene-2-carboxamide, C12H8F2N2OS2
| Molecular Formula | C12H8F2N2OS2 |
|---|---|
| Molecular Weight | 298.00 g/mol |
| LogP | 3.1531 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 298.0046 |
| Heavy Atoms | 19 |
| Complexity | 614.1969 |
Chemical Identifiers
| CAS Number | 900769-45-1 |
|---|---|
| SMILES | C1=CSC(=C1)C(=O)NC(=S)NC2=C(C=C(C=C2)F)F |
Product Overview
N-(2,4-difluorophenyl)-N'-(2-thienylcarbonyl)thiourea (CAS 900769-45-1), with molecular formula C12H8F2N2OS2 and molecular weight 298.00 g/mol. IUPAC: N-[(2,4-difluorophenyl)carbamothioyl]thiophene-2-carboxamide.
Chemical Property Profile of N-(2,4-difluorophenyl)-N'-(2-thienylcarbonyl)thiourea
Property Insights of N-(2,4-difluorophenyl)-N'-(2-thienylcarbonyl)thiourea
The XLogP value of 3.1531 indicates that N-(2,4-difluorophenyl)-N'-(2-thienylcarbonyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.13 Ų, N-(2,4-difluorophenyl)-N'-(2-thienylcarbonyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2,4-difluorophenyl)-N'-(2-thienylcarbonyl)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-(2,4-difluorophenyl)-N'-(2-thienylcarbonyl)thiourea?
The CAS number of N-(2,4-difluorophenyl)-N'-(2-thienylcarbonyl)thiourea is 900769-45-1.
What is the molecular formula of N-(2,4-difluorophenyl)-N'-(2-thienylcarbonyl)thiourea?
The molecular formula of N-(2,4-difluorophenyl)-N'-(2-thienylcarbonyl)thiourea is C12H8F2N2OS2.
What is the molecular weight of N-(2,4-difluorophenyl)-N'-(2-thienylcarbonyl)thiourea?
The molecular weight of N-(2,4-difluorophenyl)-N'-(2-thienylcarbonyl)thiourea is 298.00 g/mol.
Where can I buy N-(2,4-difluorophenyl)-N'-(2-thienylcarbonyl)thiourea?
You can request a quote for N-(2,4-difluorophenyl)-N'-(2-thienylcarbonyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,4-difluorophenyl)-N'-(2-thienylcarbonyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for N-(2,4-difluorophenyl)-N'-(2-thienylcarbonyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.