(3,4-Diaminophenyl) (2-thienyl) ketone
TL;DR: (3,4-Diaminophenyl) (2-thienyl) ketone (CAS 355115-86-5) is a chemical compound with molecular formula C11H10N2OS and molecular weight 218.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,4-diaminophenyl)-thiophen-2-ylmethanone
Also Known As: Ketone, (3,4-Diaminophenyl) (2-thienyl) ketone, EINECS 281-057-0, (3,4-diaminophenyl)-thiophen-2-ylmethanone, 4-Thenoyl-1,2-phenylenediamine
| Molecular Formula | C11H10N2OS |
|---|---|
| Molecular Weight | 218.05 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 97.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 218.05139 |
| Heavy Atoms | 15 |
| Complexity | 247.0 |
Chemical Identifiers
| CAS Number | 355115-86-5 |
|---|---|
| SMILES | C1=CSC(=C1)C(=O)C2=CC(=C(C=C2)N)N |
| InChIKey | OVVRQDDFAJNUGP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(3,4-Diaminophenyl) (2-thienyl) ketone (CAS 355115-86-5), with molecular formula C11H10N2OS and molecular weight 218.05 g/mol. IUPAC: (3,4-diaminophenyl)-thiophen-2-ylmethanone.
Chemical Property Profile of (3,4-Diaminophenyl) (2-thienyl) ketone
Property Insights of (3,4-Diaminophenyl) (2-thienyl) ketone
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3,4-Diaminophenyl) (2-thienyl) ketone. The TPSA of 97.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (3,4-Diaminophenyl) (2-thienyl) ketone. Following Lipinski's Rule of Five, (3,4-Diaminophenyl) (2-thienyl) ketone has 2 hydrogen bond donor(s) and 4 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 (3,4-Diaminophenyl) (2-thienyl) ketone?
The CAS number of (3,4-Diaminophenyl) (2-thienyl) ketone is 355115-86-5.
What is the molecular formula of (3,4-Diaminophenyl) (2-thienyl) ketone?
The molecular formula of (3,4-Diaminophenyl) (2-thienyl) ketone is C11H10N2OS.
What is the molecular weight of (3,4-Diaminophenyl) (2-thienyl) ketone?
The molecular weight of (3,4-Diaminophenyl) (2-thienyl) ketone is 218.05 g/mol.
Where can I buy (3,4-Diaminophenyl) (2-thienyl) ketone?
You can request a quote for (3,4-Diaminophenyl) (2-thienyl) ketone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3,4-Diaminophenyl) (2-thienyl) ketone?
Yes, KEHONG BIO provides custom synthesis services for (3,4-Diaminophenyl) (2-thienyl) ketone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.