BIM-0032814.P001
TL;DR: BIM-0032814.P001 (CAS 952576-48-6) is a chemical compound with molecular formula C10H9N5OS and molecular weight 247.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methyl-4-[(E)-pyridin-2-ylmethylideneamino]-3-sulfanylidene-2H-1,2,4-triazin-5-one
Also Known As: BIM-0032814.P001, J2.412.257C, F3095-1422, (E)-6-methyl-4-((pyridin-2-ylmethylene)amino)-3-thioxo-3,4-dihydro-1,2,4-triazin-5(2H)-one, 6-methyl-4-[(E)-pyridin-2-ylmethylideneamino]-3-sulfanylidene-2H-1,2,4-triazin-5-one
| Molecular Formula | C10H9N5OS |
|---|---|
| Molecular Weight | 247.05 g/mol |
| LogP | 0.88651 |
| Topological Polar Surface Area | 75.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 247.05278 |
| Heavy Atoms | 17 |
| Complexity | 658.3867 |
Chemical Identifiers
| CAS Number | 952576-48-6 |
|---|---|
| SMILES | CC1=NNC(=S)N(C1=O)/N=C/C2=CC=CC=N2 |
Product Overview
BIM-0032814.P001 (CAS 952576-48-6), with molecular formula C10H9N5OS and molecular weight 247.05 g/mol. IUPAC: 6-methyl-4-[(E)-pyridin-2-ylmethylideneamino]-3-sulfanylidene-2H-1,2,4-triazin-5-one.
Chemical Property Profile of BIM-0032814.P001
Property Insights of BIM-0032814.P001
The XLogP value of 0.88651 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BIM-0032814.P001. The TPSA of 75.93 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0032814.P001. Following Lipinski's Rule of Five, BIM-0032814.P001 has 1 hydrogen bond donor(s) and 5 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 BIM-0032814.P001?
The CAS number of BIM-0032814.P001 is 952576-48-6.
What is the molecular formula of BIM-0032814.P001?
The molecular formula of BIM-0032814.P001 is C10H9N5OS.
What is the molecular weight of BIM-0032814.P001?
The molecular weight of BIM-0032814.P001 is 247.05 g/mol.
Where can I buy BIM-0032814.P001?
You can request a quote for BIM-0032814.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0032814.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0032814.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.