TimTec1_001877
TL;DR: TimTec1_001877 (CAS 1396965-50-6) is a chemical compound with molecular formula C10H16N4O3S and molecular weight 272.0943 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-methylpropyl 2-[(5-oxo-3-sulfanylidene-2H-1,2,4-triazin-6-yl)amino]propanoate
Also Known As: TimTec1_001877, BAS 00572838, BRD-A27172511-001-01-3, F0918-0365, isobutyl 2-((5-oxo-3-thioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino)propanoate
Technical Specifications
| Molecular Formula | C10H16N4O3S |
| Molecular Weight | 272.0943 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 124.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 272.0943 Da |
| Heavy Atoms | 18 |
| Complexity | 395.0 |
| SMILES | CC(C)COC(=O)C(C)NC1=NNC(=S)NC1=O |
| InChIKey | KABRUIQEKSGTTQ-UHFFFAOYSA-N |
Chemical Property Profile of TimTec1_001877
Property Insights of TimTec1_001877
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for TimTec1_001877. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for TimTec1_001877. Following Lipinski's Rule of Five, TimTec1_001877 has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of TimTec1_001877?
The CAS number of TimTec1_001877 is 1396965-50-6.
What is the molecular formula of TimTec1_001877?
The molecular formula of TimTec1_001877 is C10H16N4O3S.
What is the molecular weight of TimTec1_001877?
The molecular weight of TimTec1_001877 is 272.0943 g/mol.
Where can I buy TimTec1_001877?
You can request a quote for TimTec1_001877 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for TimTec1_001877?
Yes, CoreyChem provides custom synthesis services for TimTec1_001877 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.