![rel-(5R,7R)-2-Amino-4,7-dihydro-5,7-diphenyl-5H-thieno[2,3-c]thiopyran-3-carbonitrile structure](/static/products/4216/42160-00-9.webp)
rel-(5R,7R)-2-Amino-4,7-dihydro-5,7-diphenyl-5H-thieno[2,3-c]thiopyran-3-carbonitrile
TL;DR: rel-(5R,7R)-2-Amino-4,7-dihydro-5,7-diphenyl-5H-thieno[2,3-c]thiopyran-3-carbonitrile (CAS 42160-00-9) is a chemical compound with molecular formula C20H16N2S2 and molecular weight 348.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5S,7S)-2-amino-5,7-diphenyl-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-carbonitrile
Also Known As: rel-(5R,7R)-2-Amino-4,7-dihydro-5,7-diphenyl-5H-thieno[2,3-c]thiopyran-3-carbonitrile, (5S,7S)-2-Amino-5,7-diphenyl-4,7-dihydro-5H-thieno[2,3-c]thiopyran-3-carbonitrile, (5S,7S)-2-amino-5,7-diphenyl-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-carbonitrile
| Molecular Formula | C20H16N2S2 |
|---|---|
| Molecular Weight | 348.08 g/mol |
| LogP | 5.32198 |
| Topological Polar Surface Area | 49.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 348.0755 |
| Heavy Atoms | 24 |
| Complexity | 894.6383 |
Chemical Identifiers
| CAS Number | 42160-00-9 |
|---|---|
| SMILES | C1[C@H](S[C@H](C2=C1C(=C(S2)N)C#N)C3=CC=CC=C3)C4=CC=CC=C4 |
Product Overview
rel-(5R,7R)-2-Amino-4,7-dihydro-5,7-diphenyl-5H-thieno[2,3-c]thiopyran-3-carbonitrile (CAS 42160-00-9), with molecular formula C20H16N2S2 and molecular weight 348.08 g/mol. IUPAC: (5S,7S)-2-amino-5,7-diphenyl-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-carbonitrile.
Chemical Property Profile of rel-(5R,7R)-2-Amino-4,7-dihydro-5,7-diphenyl-5H-thieno[2,3-c]thiopyran-3-carbonitrile
Property Insights of rel-(5R,7R)-2-Amino-4,7-dihydro-5,7-diphenyl-5H-thieno[2,3-c]thiopyran-3-carbonitrile
The XLogP value of 5.32198 indicates that rel-(5R,7R)-2-Amino-4,7-dihydro-5,7-diphenyl-5H-thieno[2,3-c]thiopyran-3-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.81 Ų, rel-(5R,7R)-2-Amino-4,7-dihydro-5,7-diphenyl-5H-thieno[2,3-c]thiopyran-3-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, rel-(5R,7R)-2-Amino-4,7-dihydro-5,7-diphenyl-5H-thieno[2,3-c]thiopyran-3-carbonitrile has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of rel-(5R,7R)-2-Amino-4,7-dihydro-5,7-diphenyl-5H-thieno[2,3-c]thiopyran-3-carbonitrile?
The CAS number of rel-(5R,7R)-2-Amino-4,7-dihydro-5,7-diphenyl-5H-thieno[2,3-c]thiopyran-3-carbonitrile is 42160-00-9.
What is the molecular formula of rel-(5R,7R)-2-Amino-4,7-dihydro-5,7-diphenyl-5H-thieno[2,3-c]thiopyran-3-carbonitrile?
The molecular formula of rel-(5R,7R)-2-Amino-4,7-dihydro-5,7-diphenyl-5H-thieno[2,3-c]thiopyran-3-carbonitrile is C20H16N2S2.
What is the molecular weight of rel-(5R,7R)-2-Amino-4,7-dihydro-5,7-diphenyl-5H-thieno[2,3-c]thiopyran-3-carbonitrile?
The molecular weight of rel-(5R,7R)-2-Amino-4,7-dihydro-5,7-diphenyl-5H-thieno[2,3-c]thiopyran-3-carbonitrile is 348.08 g/mol.
Where can I buy rel-(5R,7R)-2-Amino-4,7-dihydro-5,7-diphenyl-5H-thieno[2,3-c]thiopyran-3-carbonitrile?
You can request a quote for rel-(5R,7R)-2-Amino-4,7-dihydro-5,7-diphenyl-5H-thieno[2,3-c]thiopyran-3-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for rel-(5R,7R)-2-Amino-4,7-dihydro-5,7-diphenyl-5H-thieno[2,3-c]thiopyran-3-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for rel-(5R,7R)-2-Amino-4,7-dihydro-5,7-diphenyl-5H-thieno[2,3-c]thiopyran-3-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.