BAS 07529063
TL;DR: BAS 07529063 (CAS 669744-13-2) is a chemical compound with molecular formula C14H16N8OS and molecular weight 344.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-N-(2-methoxyphenyl)-6-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine
Also Known As: BAS 07529063, AJ-292/42490235, N-(2-Methoxy-phenyl)-6-(4-methyl-4H-[1,2,4]triazol-3-ylsulfanylmethyl)-[1,3,5]triazine-2,4-diamine, N-(4-amino-6-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,3,5-triazin-2-yl)-N-(2-methoxyphenyl)amine, (4Z)-4-[(2-methoxyphenyl)imino]-6-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-4,5-dihydro-1,3,5-triazin-2-amine
| Molecular Formula | C14H16N8OS |
|---|---|
| Molecular Weight | 344.12 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 142.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 344.1168 |
| Heavy Atoms | 24 |
| Complexity | 392.0 |
Chemical Identifiers
| CAS Number | 669744-13-2 |
|---|---|
| SMILES | CN1C=NN=C1SCC2=NC(=NC(=N2)NC3=CC=CC=C3OC)N |
| InChIKey | GZCQDQHXARETSS-UHFFFAOYSA-N |
Product Overview
BAS 07529063 (CAS 669744-13-2), with molecular formula C14H16N8OS and molecular weight 344.12 g/mol. IUPAC: 2-N-(2-methoxyphenyl)-6-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine.
Chemical Property Profile of BAS 07529063
Property Insights of BAS 07529063
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 07529063. The TPSA of 142.0 Ų indicates high polarity, suggesting BAS 07529063 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, BAS 07529063 has 2 hydrogen bond donor(s) and 9 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 07529063?
The CAS number of BAS 07529063 is 669744-13-2.
What is the molecular formula of BAS 07529063?
The molecular formula of BAS 07529063 is C14H16N8OS.
What is the molecular weight of BAS 07529063?
The molecular weight of BAS 07529063 is 344.12 g/mol.
Where can I buy BAS 07529063?
You can request a quote for BAS 07529063 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 07529063?
Yes, KEHONG BIO provides custom synthesis services for BAS 07529063 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.