(4S)-3,4-dihydro-2H-1-benzothiopyran-4-amine
TL;DR: (4S)-3,4-dihydro-2H-1-benzothiopyran-4-amine (CAS 314081-28-2) 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.
(4S)-3,4-dihydro-2H-thiochromen-4-amine
Also Known As: (4S)-3,4-dihydro-2H-1-benzothiopyran-4-amine, (S)-thiochroman-4-amine, (4S)-3,4-dihydro-2H-thiochromen-4-amine, BAS 01088742, J2.616.312I
| Molecular Formula | C9H11NS |
|---|---|
| Molecular Weight | 165.06 g/mol |
| LogP | 2.1822 |
| Topological Polar Surface Area | 26.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 165.06122 |
| Heavy Atoms | 11 |
| Complexity | 259.49457 |
Chemical Identifiers
| CAS Number | 314081-28-2 |
|---|---|
| SMILES | C1CSC2=CC=CC=C2[C@H]1N |
Product Overview
(4S)-3,4-dihydro-2H-1-benzothiopyran-4-amine (CAS 314081-28-2), with molecular formula C9H11NS and molecular weight 165.06 g/mol. IUPAC: (4S)-3,4-dihydro-2H-thiochromen-4-amine.
Chemical Property Profile of (4S)-3,4-dihydro-2H-1-benzothiopyran-4-amine
Property Insights of (4S)-3,4-dihydro-2H-1-benzothiopyran-4-amine
The XLogP value of 2.1822 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4S)-3,4-dihydro-2H-1-benzothiopyran-4-amine. With a topological polar surface area (TPSA) of 26.02 Ų, (4S)-3,4-dihydro-2H-1-benzothiopyran-4-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4S)-3,4-dihydro-2H-1-benzothiopyran-4-amine 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 (4S)-3,4-dihydro-2H-1-benzothiopyran-4-amine?
The CAS number of (4S)-3,4-dihydro-2H-1-benzothiopyran-4-amine is 314081-28-2.
What is the molecular formula of (4S)-3,4-dihydro-2H-1-benzothiopyran-4-amine?
The molecular formula of (4S)-3,4-dihydro-2H-1-benzothiopyran-4-amine is C9H11NS.
What is the molecular weight of (4S)-3,4-dihydro-2H-1-benzothiopyran-4-amine?
The molecular weight of (4S)-3,4-dihydro-2H-1-benzothiopyran-4-amine is 165.06 g/mol.
Where can I buy (4S)-3,4-dihydro-2H-1-benzothiopyran-4-amine?
You can request a quote for (4S)-3,4-dihydro-2H-1-benzothiopyran-4-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4S)-3,4-dihydro-2H-1-benzothiopyran-4-amine?
Yes, KEHONG BIO provides custom synthesis services for (4S)-3,4-dihydro-2H-1-benzothiopyran-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.