DivK1c_005513
TL;DR: DivK1c_005513 (CAS 328022-06-6) is a chemical compound with molecular formula C11H14N4S and molecular weight 234.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,7-dimethyl-3-(2-methylprop-2-enylsulfanyl)-[1,2,4]triazolo[4,3-a]pyrimidine
Also Known As: DivK1c_005513, CDS1_004473, BAS 01152556, BIM-0030125.P001, AB00101547-01
| Molecular Formula | C11H14N4S |
|---|---|
| Molecular Weight | 234.09 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 68.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 234.09392 |
| Heavy Atoms | 16 |
| Complexity | 271.0 |
Chemical Identifiers
| CAS Number | 328022-06-6 |
|---|---|
| SMILES | CC1=CC(=NC2=NN=C(N12)SCC(=C)C)C |
| InChIKey | MFHRYZSWYBTONK-UHFFFAOYSA-N |
Product Overview
DivK1c_005513 (CAS 328022-06-6), with molecular formula C11H14N4S and molecular weight 234.09 g/mol. IUPAC: 5,7-dimethyl-3-(2-methylprop-2-enylsulfanyl)-[1,2,4]triazolo[4,3-a]pyrimidine.
Chemical Property Profile of DivK1c_005513
Property Insights of DivK1c_005513
The XLogP value of 3.4 indicates that DivK1c_005513 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.4 Ų falls within the moderate polarity range, balancing permeability and solubility for DivK1c_005513. Following Lipinski's Rule of Five, DivK1c_005513 has 0 hydrogen bond donor(s) and 4 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 DivK1c_005513?
The CAS number of DivK1c_005513 is 328022-06-6.
What is the molecular formula of DivK1c_005513?
The molecular formula of DivK1c_005513 is C11H14N4S.
What is the molecular weight of DivK1c_005513?
The molecular weight of DivK1c_005513 is 234.09 g/mol.
Where can I buy DivK1c_005513?
You can request a quote for DivK1c_005513 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for DivK1c_005513?
Yes, KEHONG BIO provides custom synthesis services for DivK1c_005513 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.