![4-(8-butyl-5-cyano-3,3-dimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridin-6-yl)-N-phenylpiperazine-1-carbothioamide structure](/static/products/372/372087-25-7.png)
4-(8-butyl-5-cyano-3,3-dimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridin-6-yl)-N-phenylpiperazine-1-carbothioamide
TL;DR: 4-(8-butyl-5-cyano-3,3-dimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridin-6-yl)-N-phenylpiperazine-1-carbothioamide (CAS 372087-25-7) is a chemical compound with molecular formula C26H33N5S2 and molecular weight 479.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(8-butyl-5-cyano-3,3-dimethyl-1,4-dihydrothiopyrano[3,4-c]pyridin-6-yl)-N-phenylpiperazine-1-carbothioamide
Also Known As: 4-(8-butyl-5-cyano-3,3-dimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridin-6-yl)-N-phenylpiperazine-1-carbothioamide, 4-(8-butyl-5-cyano-3,3-dimethyl-1,4-dihydrothiopyrano[3,4-c]pyridin-6-yl)-N-phenylpiperazine-1-carbothioamide
| Molecular Formula | C26H33N5S2 |
|---|---|
| Molecular Weight | 479.22 g/mol |
| LogP | 5.38278 |
| Topological Polar Surface Area | 55.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 479.21774 |
| Heavy Atoms | 33 |
| Complexity | 1036.8832 |
Chemical Identifiers
| CAS Number | 372087-25-7 |
|---|---|
| SMILES | CCCCC1=NC(=C(C2=C1CSC(C2)(C)C)C#N)N3CCN(CC3)C(=S)NC4=CC=CC=C4 |
Product Overview
4-(8-butyl-5-cyano-3,3-dimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridin-6-yl)-N-phenylpiperazine-1-carbothioamide (CAS 372087-25-7), with molecular formula C26H33N5S2 and molecular weight 479.22 g/mol. IUPAC: 4-(8-butyl-5-cyano-3,3-dimethyl-1,4-dihydrothiopyrano[3,4-c]pyridin-6-yl)-N-phenylpiperazine-1-carbothioamide.
Chemical Property Profile of 4-(8-butyl-5-cyano-3,3-dimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridin-6-yl)-N-phenylpiperazine-1-carbothioamide
Property Insights of 4-(8-butyl-5-cyano-3,3-dimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridin-6-yl)-N-phenylpiperazine-1-carbothioamide
The XLogP value of 5.38278 indicates that 4-(8-butyl-5-cyano-3,3-dimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridin-6-yl)-N-phenylpiperazine-1-carbothioamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.19 Ų, 4-(8-butyl-5-cyano-3,3-dimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridin-6-yl)-N-phenylpiperazine-1-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(8-butyl-5-cyano-3,3-dimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridin-6-yl)-N-phenylpiperazine-1-carbothioamide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(8-butyl-5-cyano-3,3-dimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridin-6-yl)-N-phenylpiperazine-1-carbothioamide?
The CAS number of 4-(8-butyl-5-cyano-3,3-dimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridin-6-yl)-N-phenylpiperazine-1-carbothioamide is 372087-25-7.
What is the molecular formula of 4-(8-butyl-5-cyano-3,3-dimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridin-6-yl)-N-phenylpiperazine-1-carbothioamide?
The molecular formula of 4-(8-butyl-5-cyano-3,3-dimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridin-6-yl)-N-phenylpiperazine-1-carbothioamide is C26H33N5S2.
What is the molecular weight of 4-(8-butyl-5-cyano-3,3-dimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridin-6-yl)-N-phenylpiperazine-1-carbothioamide?
The molecular weight of 4-(8-butyl-5-cyano-3,3-dimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridin-6-yl)-N-phenylpiperazine-1-carbothioamide is 479.22 g/mol.
Where can I buy 4-(8-butyl-5-cyano-3,3-dimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridin-6-yl)-N-phenylpiperazine-1-carbothioamide?
You can request a quote for 4-(8-butyl-5-cyano-3,3-dimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridin-6-yl)-N-phenylpiperazine-1-carbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(8-butyl-5-cyano-3,3-dimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridin-6-yl)-N-phenylpiperazine-1-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 4-(8-butyl-5-cyano-3,3-dimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridin-6-yl)-N-phenylpiperazine-1-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.