1-benzyl-3-[(E)-furan-2-ylmethylideneamino]thiourea
TL;DR: 1-benzyl-3-[(E)-furan-2-ylmethylideneamino]thiourea (CAS 147151-96-0) is a chemical compound with molecular formula C13H13N3OS and molecular weight 259.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-3-[(E)-furan-2-ylmethylideneamino]thiourea
Also Known As: 1-benzyl-3-[(E)-furan-2-ylmethylideneamino]thiourea, AB00104992-01, (2E)-N-benzyl-2-(furan-2-ylmethylidene)hydrazinecarbothioamide, (1E,3E)-4-(2-furyl)-1-[benzylamino]-2,3-diazabuta-1,3-diene-1-thiol
| Molecular Formula | C13H13N3OS |
|---|---|
| Molecular Weight | 259.08 g/mol |
| LogP | 2.2778 |
| Topological Polar Surface Area | 49.56 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 259.07794 |
| Heavy Atoms | 18 |
| Complexity | 508.29733 |
Chemical Identifiers
| CAS Number | 147151-96-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC(=S)N/N=C/C2=CC=CO2 |
Product Overview
1-benzyl-3-[(E)-furan-2-ylmethylideneamino]thiourea (CAS 147151-96-0), with molecular formula C13H13N3OS and molecular weight 259.08 g/mol. IUPAC: 1-benzyl-3-[(E)-furan-2-ylmethylideneamino]thiourea.
Chemical Property Profile of 1-benzyl-3-[(E)-furan-2-ylmethylideneamino]thiourea
Property Insights of 1-benzyl-3-[(E)-furan-2-ylmethylideneamino]thiourea
The XLogP value of 2.2778 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-benzyl-3-[(E)-furan-2-ylmethylideneamino]thiourea. With a topological polar surface area (TPSA) of 49.56 Ų, 1-benzyl-3-[(E)-furan-2-ylmethylideneamino]thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-benzyl-3-[(E)-furan-2-ylmethylideneamino]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-benzyl-3-[(E)-furan-2-ylmethylideneamino]thiourea?
The CAS number of 1-benzyl-3-[(E)-furan-2-ylmethylideneamino]thiourea is 147151-96-0.
What is the molecular formula of 1-benzyl-3-[(E)-furan-2-ylmethylideneamino]thiourea?
The molecular formula of 1-benzyl-3-[(E)-furan-2-ylmethylideneamino]thiourea is C13H13N3OS.
What is the molecular weight of 1-benzyl-3-[(E)-furan-2-ylmethylideneamino]thiourea?
The molecular weight of 1-benzyl-3-[(E)-furan-2-ylmethylideneamino]thiourea is 259.08 g/mol.
Where can I buy 1-benzyl-3-[(E)-furan-2-ylmethylideneamino]thiourea?
You can request a quote for 1-benzyl-3-[(E)-furan-2-ylmethylideneamino]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-benzyl-3-[(E)-furan-2-ylmethylideneamino]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-benzyl-3-[(E)-furan-2-ylmethylideneamino]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.