3-(4-Methylbenzoyl)thiophen-2-amine
TL;DR: 3-(4-Methylbenzoyl)thiophen-2-amine (CAS 436093-35-5) is a chemical compound with molecular formula C12H11NOS and molecular weight 217.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-aminothiophen-3-yl)-(4-methylphenyl)methanone
Also Known As: 3-(4-methylbenzoyl)thiophen-2-amine, (2-AMINOTHIOPHEN-3-YL)(P-TOLYL)METHANONE, (2-amino-3-thienyl)(4-methylphenyl)methanone, 2-amino-3-(4-methylbenzoyl)thiophene, (2-aminothiophen-3-yl)-(4-methylphenyl)methanone
| Molecular Formula | C12H11NOS |
|---|---|
| Molecular Weight | 217.06 g/mol |
| LogP | 2.86972 |
| Topological Polar Surface Area | 43.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 217.05614 |
| Heavy Atoms | 15 |
| Complexity | 484.57816 |
Chemical Identifiers
| CAS Number | 436093-35-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)C2=C(SC=C2)N |
Product Overview
3-(4-Methylbenzoyl)thiophen-2-amine (CAS 436093-35-5), with molecular formula C12H11NOS and molecular weight 217.06 g/mol. IUPAC: (2-aminothiophen-3-yl)-(4-methylphenyl)methanone.
Chemical Property Profile of 3-(4-Methylbenzoyl)thiophen-2-amine
Property Insights of 3-(4-Methylbenzoyl)thiophen-2-amine
The XLogP value of 2.86972 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Methylbenzoyl)thiophen-2-amine. With a topological polar surface area (TPSA) of 43.09 Ų, 3-(4-Methylbenzoyl)thiophen-2-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Methylbenzoyl)thiophen-2-amine has 1 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 3-(4-Methylbenzoyl)thiophen-2-amine?
The CAS number of 3-(4-Methylbenzoyl)thiophen-2-amine is 436093-35-5.
What is the molecular formula of 3-(4-Methylbenzoyl)thiophen-2-amine?
The molecular formula of 3-(4-Methylbenzoyl)thiophen-2-amine is C12H11NOS.
What is the molecular weight of 3-(4-Methylbenzoyl)thiophen-2-amine?
The molecular weight of 3-(4-Methylbenzoyl)thiophen-2-amine is 217.06 g/mol.
Where can I buy 3-(4-Methylbenzoyl)thiophen-2-amine?
You can request a quote for 3-(4-Methylbenzoyl)thiophen-2-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Methylbenzoyl)thiophen-2-amine?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Methylbenzoyl)thiophen-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.