BAS 02232581
TL;DR: BAS 02232581 (CAS 374608-24-9) is a chemical compound with molecular formula C14H17N9S4 and molecular weight 439.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-5-[[4-(4-methylpiperazin-1-yl)-6-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1,3,5-triazin-2-yl]sulfanyl]-1,3,4-thiadiazole
Also Known As: BAS 02232581, 2-methyl-5-[[4-(4-methylpiperazin-1-yl)-6-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1,3,5-triazin-2-yl]sulfanyl]-1,3,4-thiadiazole, 2-(4-Methyl-piperazin-1-yl)-4,6-bis-(5-methyl-[1,3,4]thiadiazol-2-ylsulfanyl)-[1,3,5]triazine, 2-(4-methylpiperazin-1-yl)-4,6-bis[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1,3,5-triazine, 2-methyl-5-[[4-(4-methyl-1-piperazinyl)-6-[(5-methyl-1,3,4-thiadiazol-2-yl)thio]-1,3,5-triazin-2-yl]thio]-1,3,4-thiadiazole
| Molecular Formula | C14H17N9S4 |
|---|---|
| Molecular Weight | 439.05 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 204.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 5 |
| Exact Mass | 439.04898 |
| Heavy Atoms | 27 |
| Complexity | 454.0 |
Chemical Identifiers
| CAS Number | 374608-24-9 |
|---|---|
| SMILES | CC1=NN=C(S1)SC2=NC(=NC(=N2)N3CCN(CC3)C)SC4=NN=C(S4)C |
| InChIKey | QXONZSTYGSFSTK-UHFFFAOYSA-N |
Product Overview
BAS 02232581 (CAS 374608-24-9), with molecular formula C14H17N9S4 and molecular weight 439.05 g/mol. IUPAC: 2-methyl-5-[[4-(4-methylpiperazin-1-yl)-6-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1,3,5-triazin-2-yl]sulfanyl]-1,3,4-thiadiazole.
Chemical Property Profile of BAS 02232581
Property Insights of BAS 02232581
The XLogP value of 3.4 indicates that BAS 02232581 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 204.0 Ų indicates high polarity, suggesting BAS 02232581 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, BAS 02232581 has 0 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 02232581?
The CAS number of BAS 02232581 is 374608-24-9.
What is the molecular formula of BAS 02232581?
The molecular formula of BAS 02232581 is C14H17N9S4.
What is the molecular weight of BAS 02232581?
The molecular weight of BAS 02232581 is 439.05 g/mol.
Where can I buy BAS 02232581?
You can request a quote for BAS 02232581 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02232581?
Yes, KEHONG BIO provides custom synthesis services for BAS 02232581 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.