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N-[(4-methylphenyl)carbamothioyl]furan-2-carboxamide
TL;DR: N-[(4-methylphenyl)carbamothioyl]furan-2-carboxamide (CAS 77336-98-2) is a chemical compound with molecular formula C13H12N2O2S and molecular weight 260.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-methylphenyl)carbamothioyl]furan-2-carboxamide
Also Known As: N-[(4-methylphenyl)carbamothioyl]furan-2-carboxamide, BIM-0035252.P001, 1-(2-Furoyl)-3-(4-methylphenyl)thiourea, n-(2-furoyl)-n'-(4-methylphenyl)thiourea, J1.703.465K
| Molecular Formula | C13H12N2O2S |
|---|---|
| Molecular Weight | 260.06 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 86.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 260.06195 |
| Heavy Atoms | 18 |
| Complexity | 314.0 |
Chemical Identifiers
| CAS Number | 77336-98-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=CO2 |
| InChIKey | RALURLMXXCHCDQ-UHFFFAOYSA-N |
Product Overview
N-[(4-methylphenyl)carbamothioyl]furan-2-carboxamide (CAS 77336-98-2), with molecular formula C13H12N2O2S and molecular weight 260.06 g/mol. IUPAC: N-[(4-methylphenyl)carbamothioyl]furan-2-carboxamide.
Chemical Property Profile of N-[(4-methylphenyl)carbamothioyl]furan-2-carboxamide
Property Insights of N-[(4-methylphenyl)carbamothioyl]furan-2-carboxamide
The XLogP value of 3.3 indicates that N-[(4-methylphenyl)carbamothioyl]furan-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(4-methylphenyl)carbamothioyl]furan-2-carboxamide. Following Lipinski's Rule of Five, N-[(4-methylphenyl)carbamothioyl]furan-2-carboxamide 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-methylphenyl)carbamothioyl]furan-2-carboxamide?
The CAS number of N-[(4-methylphenyl)carbamothioyl]furan-2-carboxamide is 77336-98-2.
What is the molecular formula of N-[(4-methylphenyl)carbamothioyl]furan-2-carboxamide?
The molecular formula of N-[(4-methylphenyl)carbamothioyl]furan-2-carboxamide is C13H12N2O2S.
What is the molecular weight of N-[(4-methylphenyl)carbamothioyl]furan-2-carboxamide?
The molecular weight of N-[(4-methylphenyl)carbamothioyl]furan-2-carboxamide is 260.06 g/mol.
Where can I buy N-[(4-methylphenyl)carbamothioyl]furan-2-carboxamide?
You can request a quote for N-[(4-methylphenyl)carbamothioyl]furan-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(4-methylphenyl)carbamothioyl]furan-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(4-methylphenyl)carbamothioyl]furan-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.