1-(4,6-bis(p-tolylamino)-1,3,5-triazin-2-yl)-3-methyl-1H-imidazole-2(3H)-thione
TL;DR: 1-(4,6-bis(p-tolylamino)-1,3,5-triazin-2-yl)-3-methyl-1H-imidazole-2(3H)-thione (CAS 370576-70-8) is a chemical compound with molecular formula C21H21N7S and molecular weight 403.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4,6-bis(4-methylanilino)-1,3,5-triazin-2-yl]-3-methylimidazole-2-thione
Also Known As: 1-(4,6-bis(p-tolylamino)-1,3,5-triazin-2-yl)-3-methyl-1H-imidazole-2(3H)-thione, 1-[4,6-bis(4-methylanilino)-1,3,5-triazin-2-yl]-3-methylimidazole-2-thione, 1-methyl-3-{(4E)-6-[(4-methylphenyl)amino]-4-[(4-methylphenyl)imino]-4,5-dihydro-1,3,5-triazin-2-yl}-1,3-dihydro-2H-imidazole-2-thione
| Molecular Formula | C21H21N7S |
|---|---|
| Molecular Weight | 403.16 g/mol |
| LogP | 4.83433 |
| Topological Polar Surface Area | 72.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 403.15793 |
| Heavy Atoms | 29 |
| Complexity | 1125.4343 |
Chemical Identifiers
| CAS Number | 370576-70-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC2=NC(=NC(=N2)N3C=CN(C3=S)C)NC4=CC=C(C=C4)C |
Product Overview
1-(4,6-bis(p-tolylamino)-1,3,5-triazin-2-yl)-3-methyl-1H-imidazole-2(3H)-thione (CAS 370576-70-8), with molecular formula C21H21N7S and molecular weight 403.16 g/mol. IUPAC: 1-[4,6-bis(4-methylanilino)-1,3,5-triazin-2-yl]-3-methylimidazole-2-thione.
Chemical Property Profile of 1-(4,6-bis(p-tolylamino)-1,3,5-triazin-2-yl)-3-methyl-1H-imidazole-2(3H)-thione
Property Insights of 1-(4,6-bis(p-tolylamino)-1,3,5-triazin-2-yl)-3-methyl-1H-imidazole-2(3H)-thione
The XLogP value of 4.83433 indicates that 1-(4,6-bis(p-tolylamino)-1,3,5-triazin-2-yl)-3-methyl-1H-imidazole-2(3H)-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.59 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4,6-bis(p-tolylamino)-1,3,5-triazin-2-yl)-3-methyl-1H-imidazole-2(3H)-thione. Following Lipinski's Rule of Five, 1-(4,6-bis(p-tolylamino)-1,3,5-triazin-2-yl)-3-methyl-1H-imidazole-2(3H)-thione has 2 hydrogen bond donor(s) and 6 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 1-(4,6-bis(p-tolylamino)-1,3,5-triazin-2-yl)-3-methyl-1H-imidazole-2(3H)-thione?
The CAS number of 1-(4,6-bis(p-tolylamino)-1,3,5-triazin-2-yl)-3-methyl-1H-imidazole-2(3H)-thione is 370576-70-8.
What is the molecular formula of 1-(4,6-bis(p-tolylamino)-1,3,5-triazin-2-yl)-3-methyl-1H-imidazole-2(3H)-thione?
The molecular formula of 1-(4,6-bis(p-tolylamino)-1,3,5-triazin-2-yl)-3-methyl-1H-imidazole-2(3H)-thione is C21H21N7S.
What is the molecular weight of 1-(4,6-bis(p-tolylamino)-1,3,5-triazin-2-yl)-3-methyl-1H-imidazole-2(3H)-thione?
The molecular weight of 1-(4,6-bis(p-tolylamino)-1,3,5-triazin-2-yl)-3-methyl-1H-imidazole-2(3H)-thione is 403.16 g/mol.
Where can I buy 1-(4,6-bis(p-tolylamino)-1,3,5-triazin-2-yl)-3-methyl-1H-imidazole-2(3H)-thione?
You can request a quote for 1-(4,6-bis(p-tolylamino)-1,3,5-triazin-2-yl)-3-methyl-1H-imidazole-2(3H)-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4,6-bis(p-tolylamino)-1,3,5-triazin-2-yl)-3-methyl-1H-imidazole-2(3H)-thione?
Yes, KEHONG BIO provides custom synthesis services for 1-(4,6-bis(p-tolylamino)-1,3,5-triazin-2-yl)-3-methyl-1H-imidazole-2(3H)-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.