3,4-二氢-2H-硫代色原烯-4-胺
TL;DR: 3,4-二氢-2H-硫代色原烯-4-胺 (CAS 93192-72-4) is a chemical compound with molecular formula C9H11NS and molecular weight 165.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-二氢-2H-硫代色原烯-4-胺
3,4-dihydro-2H-thiochromen-4-amine
Also Known As: 3,4-dihydro-2H-thiochromen-4-amine, thiochroman-4-amine, 4-aminothiochroman, Thiochroman-4-ylamine, (S)-thiochroman-4-amine
| Molecular Formula | C9H11NS |
|---|---|
| Molecular Weight | 165.06 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 51.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 165.06122 |
| Heavy Atoms | 11 |
| Complexity | 138.0 |
Chemical Identifiers
| CAS Number | 93192-72-4 |
|---|---|
| SMILES | C1CSC2=CC=CC=C2C1N |
| InChIKey | XMWQQTMIZMZZHJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,4-二氢-2H-硫代色原烯-4-胺 (CAS 93192-72-4), with molecular formula C9H11NS and molecular weight 165.06 g/mol. IUPAC: 3,4-dihydro-2H-thiochromen-4-amine.
Chemical Property Profile of 3,4-二氢-2H-硫代色原烯-4-胺
Property Insights of 3,4-二氢-2H-硫代色原烯-4-胺
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-二氢-2H-硫代色原烯-4-胺. With a topological polar surface area (TPSA) of 51.3 Ų, 3,4-二氢-2H-硫代色原烯-4-胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-二氢-2H-硫代色原烯-4-胺 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 3,4-二氢-2H-硫代色原烯-4-胺?
The CAS number of 3,4-二氢-2H-硫代色原烯-4-胺 is 93192-72-4.
What is the molecular formula of 3,4-二氢-2H-硫代色原烯-4-胺?
The molecular formula of 3,4-二氢-2H-硫代色原烯-4-胺 is C9H11NS.
What is the molecular weight of 3,4-二氢-2H-硫代色原烯-4-胺?
The molecular weight of 3,4-二氢-2H-硫代色原烯-4-胺 is 165.06 g/mol.
Where can I buy 3,4-二氢-2H-硫代色原烯-4-胺?
You can request a quote for 3,4-二氢-2H-硫代色原烯-4-胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-二氢-2H-硫代色原烯-4-胺?
Yes, KEHONG BIO provides custom synthesis services for 3,4-二氢-2H-硫代色原烯-4-胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.