![6-(benzylamino)-3,3,8-trimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile structure](/static/products/138/138292-29-2.png)
6-(benzylamino)-3,3,8-trimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile
TL;DR: 6-(benzylamino)-3,3,8-trimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile (CAS 138292-29-2) is a chemical compound with molecular formula C19H21N3S and molecular weight 323.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(benzylamino)-3,3,8-trimethyl-1,4-dihydrothiopyrano[3,4-c]pyridine-5-carbonitrile
Also Known As: 6-(benzylamino)-3,3,8-trimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile, 3,3,8-trimethyl-6-[benzylamino]-1H,4H-thiino[5,4-c]pyridine-5-carbonitrile, 6-(benzylamino)-3,3,8-trimethyl-1,4-dihydrothiopyrano[3,4-c]pyridine-5-carbonitrile, 3-(benzylamino)-5,9,9-trimethyl-8-thia-4-azabicyclo[4.4.0]deca-1,3,5-triene-2-carbonitrile
| Molecular Formula | C19H21N3S |
|---|---|
| Molecular Weight | 323.15 g/mol |
| LogP | 4.4417 |
| Topological Polar Surface Area | 48.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 323.14563 |
| Heavy Atoms | 23 |
| Complexity | 760.41956 |
Chemical Identifiers
| CAS Number | 138292-29-2 |
|---|---|
| SMILES | CC1=C2CSC(CC2=C(C(=N1)NCC3=CC=CC=C3)C#N)(C)C |
Product Overview
6-(benzylamino)-3,3,8-trimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile (CAS 138292-29-2), with molecular formula C19H21N3S and molecular weight 323.15 g/mol. IUPAC: 6-(benzylamino)-3,3,8-trimethyl-1,4-dihydrothiopyrano[3,4-c]pyridine-5-carbonitrile.
Chemical Property Profile of 6-(benzylamino)-3,3,8-trimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile
Property Insights of 6-(benzylamino)-3,3,8-trimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile
The XLogP value of 4.4417 indicates that 6-(benzylamino)-3,3,8-trimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.71 Ų, 6-(benzylamino)-3,3,8-trimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-(benzylamino)-3,3,8-trimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile has 1 hydrogen bond donor(s) and 4 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 6-(benzylamino)-3,3,8-trimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile?
The CAS number of 6-(benzylamino)-3,3,8-trimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile is 138292-29-2.
What is the molecular formula of 6-(benzylamino)-3,3,8-trimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile?
The molecular formula of 6-(benzylamino)-3,3,8-trimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile is C19H21N3S.
What is the molecular weight of 6-(benzylamino)-3,3,8-trimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile?
The molecular weight of 6-(benzylamino)-3,3,8-trimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile is 323.15 g/mol.
Where can I buy 6-(benzylamino)-3,3,8-trimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile?
You can request a quote for 6-(benzylamino)-3,3,8-trimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(benzylamino)-3,3,8-trimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 6-(benzylamino)-3,3,8-trimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.