BAS 04914326
TL;DR: BAS 04914326 (CAS 496771-26-7) is a chemical compound with molecular formula C14H16N8S and molecular weight 328.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-N-(4-methylphenyl)-6-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine
Also Known As: BAS 04914326, 6-(4-Methyl-4H-[1,2,4]triazol-3-ylsulfanylmethyl)-N-p-tolyl-[1,3,5]triazine-2,4-diamine, (6Z)-6-[(4-methylphenyl)imino]-4-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,6-dihydro-1,3,5-triazin-2-amine, 2-N-(4-methylphenyl)-6-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine, 6-(((4-methyl-4H-1,2,4-triazol-3-yl)thio)methyl)-N2-(p-tolyl)-1,3,5-triazine-2,4-diamine
| Molecular Formula | C14H16N8S |
|---|---|
| Molecular Weight | 328.12 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 133.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 328.12186 |
| Heavy Atoms | 23 |
| Complexity | 365.0 |
Chemical Identifiers
| CAS Number | 496771-26-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CSC3=NN=CN3C |
| InChIKey | MCSWDMPGSLFIKN-UHFFFAOYSA-N |
Product Overview
BAS 04914326 (CAS 496771-26-7), with molecular formula C14H16N8S and molecular weight 328.12 g/mol. IUPAC: 2-N-(4-methylphenyl)-6-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine.
Chemical Property Profile of BAS 04914326
Property Insights of BAS 04914326
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 04914326. The TPSA of 133.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 04914326. Following Lipinski's Rule of Five, BAS 04914326 has 2 hydrogen bond donor(s) and 8 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 BAS 04914326?
The CAS number of BAS 04914326 is 496771-26-7.
What is the molecular formula of BAS 04914326?
The molecular formula of BAS 04914326 is C14H16N8S.
What is the molecular weight of BAS 04914326?
The molecular weight of BAS 04914326 is 328.12 g/mol.
Where can I buy BAS 04914326?
You can request a quote for BAS 04914326 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04914326?
Yes, KEHONG BIO provides custom synthesis services for BAS 04914326 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.