(2-Hydroxyphenyl)(Pyrrolidin-1-Yl)methanethione
TL;DR: (2-Hydroxyphenyl)(Pyrrolidin-1-Yl)methanethione (CAS 84783-01-7) is a chemical compound with molecular formula C11H13NOS and molecular weight 207.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-hydroxyphenyl)-pyrrolidin-1-ylmethanethione
Also Known As: K-Ras-IN-1, (2-Hydroxyphenyl)(Pyrrolidin-1-Yl)methanethione, o-hydroxythiobenzopyrrolidide, K-Ras-IN-1?, EX-A1125
| Molecular Formula | C11H13NOS |
|---|---|
| Molecular Weight | 207.07 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 55.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 207.0718 |
| Heavy Atoms | 14 |
| Complexity | 213.0 |
Chemical Identifiers
| CAS Number | 84783-01-7 |
|---|---|
| SMILES | C1CCN(C1)C(=S)C2=CC=CC=C2O |
| InChIKey | QIKLOVZAPGSYNO-UHFFFAOYSA-N |
Product Overview
(2-Hydroxyphenyl)(Pyrrolidin-1-Yl)methanethione (CAS 84783-01-7), with molecular formula C11H13NOS and molecular weight 207.07 g/mol. IUPAC: (2-hydroxyphenyl)-pyrrolidin-1-ylmethanethione.
Chemical Property Profile of (2-Hydroxyphenyl)(Pyrrolidin-1-Yl)methanethione
Property Insights of (2-Hydroxyphenyl)(Pyrrolidin-1-Yl)methanethione
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-Hydroxyphenyl)(Pyrrolidin-1-Yl)methanethione. With a topological polar surface area (TPSA) of 55.6 Ų, (2-Hydroxyphenyl)(Pyrrolidin-1-Yl)methanethione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-Hydroxyphenyl)(Pyrrolidin-1-Yl)methanethione has 1 hydrogen bond donor(s) and 2 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 (2-Hydroxyphenyl)(Pyrrolidin-1-Yl)methanethione?
The CAS number of (2-Hydroxyphenyl)(Pyrrolidin-1-Yl)methanethione is 84783-01-7.
What is the molecular formula of (2-Hydroxyphenyl)(Pyrrolidin-1-Yl)methanethione?
The molecular formula of (2-Hydroxyphenyl)(Pyrrolidin-1-Yl)methanethione is C11H13NOS.
What is the molecular weight of (2-Hydroxyphenyl)(Pyrrolidin-1-Yl)methanethione?
The molecular weight of (2-Hydroxyphenyl)(Pyrrolidin-1-Yl)methanethione is 207.07 g/mol.
Where can I buy (2-Hydroxyphenyl)(Pyrrolidin-1-Yl)methanethione?
You can request a quote for (2-Hydroxyphenyl)(Pyrrolidin-1-Yl)methanethione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Hydroxyphenyl)(Pyrrolidin-1-Yl)methanethione?
Yes, KEHONG BIO provides custom synthesis services for (2-Hydroxyphenyl)(Pyrrolidin-1-Yl)methanethione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.