4-Anilino-6,6-dimethyl-5,6-dihydropyridine-2(1H)-thione
TL;DR: 4-Anilino-6,6-dimethyl-5,6-dihydropyridine-2(1H)-thione (CAS 58913-46-5) is a chemical compound with molecular formula C13H16N2S and molecular weight 232.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-anilino-2,2-dimethyl-1,3-dihydropyridine-6-thione
Also Known As: 4-Anilino-6,6-dimethyl-5,6-dihydropyridine-2(1H)-thione, 4-anilino-2,2-dimethyl-1,3-dihydropyridine-6-thione, 6,6-dimethyl-4-(phenylamino)-5,6-dihydropyridine-2(1h)-thione, RefChem:290160
| Molecular Formula | C13H16N2S |
|---|---|
| Molecular Weight | 232.10 g/mol |
| LogP | 3.0817 |
| Topological Polar Surface Area | 24.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 232.10342 |
| Heavy Atoms | 16 |
| Complexity | 420.81854 |
Chemical Identifiers
| CAS Number | 58913-46-5 |
|---|---|
| SMILES | CC1(CC(=CC(=S)N1)NC2=CC=CC=C2)C |
Product Overview
4-Anilino-6,6-dimethyl-5,6-dihydropyridine-2(1H)-thione (CAS 58913-46-5), with molecular formula C13H16N2S and molecular weight 232.10 g/mol. IUPAC: 4-anilino-2,2-dimethyl-1,3-dihydropyridine-6-thione.
Chemical Property Profile of 4-Anilino-6,6-dimethyl-5,6-dihydropyridine-2(1H)-thione
Property Insights of 4-Anilino-6,6-dimethyl-5,6-dihydropyridine-2(1H)-thione
The XLogP value of 3.0817 indicates that 4-Anilino-6,6-dimethyl-5,6-dihydropyridine-2(1H)-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.06 Ų, 4-Anilino-6,6-dimethyl-5,6-dihydropyridine-2(1H)-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Anilino-6,6-dimethyl-5,6-dihydropyridine-2(1H)-thione has 2 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 4-Anilino-6,6-dimethyl-5,6-dihydropyridine-2(1H)-thione?
The CAS number of 4-Anilino-6,6-dimethyl-5,6-dihydropyridine-2(1H)-thione is 58913-46-5.
What is the molecular formula of 4-Anilino-6,6-dimethyl-5,6-dihydropyridine-2(1H)-thione?
The molecular formula of 4-Anilino-6,6-dimethyl-5,6-dihydropyridine-2(1H)-thione is C13H16N2S.
What is the molecular weight of 4-Anilino-6,6-dimethyl-5,6-dihydropyridine-2(1H)-thione?
The molecular weight of 4-Anilino-6,6-dimethyl-5,6-dihydropyridine-2(1H)-thione is 232.10 g/mol.
Where can I buy 4-Anilino-6,6-dimethyl-5,6-dihydropyridine-2(1H)-thione?
You can request a quote for 4-Anilino-6,6-dimethyl-5,6-dihydropyridine-2(1H)-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Anilino-6,6-dimethyl-5,6-dihydropyridine-2(1H)-thione?
Yes, KEHONG BIO provides custom synthesis services for 4-Anilino-6,6-dimethyl-5,6-dihydropyridine-2(1H)-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.