1-Ethyl-1H-pyrrole-2-carbothioamide
TL;DR: 1-Ethyl-1H-pyrrole-2-carbothioamide (CAS 101001-60-9) is a chemical compound with molecular formula C7H10N2S and molecular weight 154.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethylpyrrole-2-carbothioamide
Also Known As: 1-Ethyl-1H-pyrrole-2-carbothioamide, 1-Ethylpyrrole-2-carbothioamide, 1H-Pyrrole-2-carbothioamide, 1-ethyl-, RefChem:230215
| Molecular Formula | C7H10N2S |
|---|---|
| Molecular Weight | 154.06 g/mol |
| LogP | 1.1422 |
| Topological Polar Surface Area | 30.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 154.05647 |
| Heavy Atoms | 10 |
| Complexity | 239.50908 |
Chemical Identifiers
| CAS Number | 101001-60-9 |
|---|---|
| SMILES | CCN1C=CC=C1C(=S)N |
Product Overview
1-Ethyl-1H-pyrrole-2-carbothioamide (CAS 101001-60-9), with molecular formula C7H10N2S and molecular weight 154.06 g/mol. IUPAC: 1-ethylpyrrole-2-carbothioamide.
Chemical Property Profile of 1-Ethyl-1H-pyrrole-2-carbothioamide
Property Insights of 1-Ethyl-1H-pyrrole-2-carbothioamide
The XLogP value of 1.1422 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Ethyl-1H-pyrrole-2-carbothioamide. With a topological polar surface area (TPSA) of 30.95 Ų, 1-Ethyl-1H-pyrrole-2-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Ethyl-1H-pyrrole-2-carbothioamide has 1 hydrogen bond donor(s) and 1 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-Ethyl-1H-pyrrole-2-carbothioamide?
The CAS number of 1-Ethyl-1H-pyrrole-2-carbothioamide is 101001-60-9.
What is the molecular formula of 1-Ethyl-1H-pyrrole-2-carbothioamide?
The molecular formula of 1-Ethyl-1H-pyrrole-2-carbothioamide is C7H10N2S.
What is the molecular weight of 1-Ethyl-1H-pyrrole-2-carbothioamide?
The molecular weight of 1-Ethyl-1H-pyrrole-2-carbothioamide is 154.06 g/mol.
Where can I buy 1-Ethyl-1H-pyrrole-2-carbothioamide?
You can request a quote for 1-Ethyl-1H-pyrrole-2-carbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Ethyl-1H-pyrrole-2-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 1-Ethyl-1H-pyrrole-2-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.