C17H16N6S
TL;DR: C17H16N6S (CAS 1025364-18-4) is a chemical compound with molecular formula C17H16N6S and molecular weight 336.11572 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(5-cyclopropyl-1H-pyrazol-3-yl)-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene
Also Known As: BAS 13776520, 2-(5-cyclopropyl-1H-pyrazol-3-yl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine, 2-(5-cyclopropyl-1H-pyrazol-3-yl)-8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Technical Specifications
| Molecular Formula | C17H16N6S |
| Molecular Weight | 336.11572 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 100.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 336.11572 Da |
| Heavy Atoms | 24 |
| Complexity | 501.0 |
| SMILES | C1CCC2=C(C1)C3=C(S2)N=CN4C3=NC(=N4)C5=NNC(=C5)C6CC6 |
| InChIKey | XRWDVBMRXPWIAL-UHFFFAOYSA-N |
Chemical Property Profile of C17H16N6S
Property Insights of C17H16N6S
The XLogP value of 3.2 indicates that C17H16N6S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for C17H16N6S. Following Lipinski's Rule of Five, C17H16N6S 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
What is the CAS number of C17H16N6S?
The CAS number of C17H16N6S is 1025364-18-4.
What is the molecular formula of C17H16N6S?
The molecular formula of C17H16N6S is C17H16N6S.
What is the molecular weight of C17H16N6S?
The molecular weight of C17H16N6S is 336.11572 g/mol.
Where can I buy C17H16N6S?
You can request a quote for C17H16N6S directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for C17H16N6S?
Yes, CoreyChem provides custom synthesis services for C17H16N6S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.