starbld0007333
TL;DR: starbld0007333 (CAS 852687-58-2) is a chemical compound with molecular formula C19H18N6OS and molecular weight 378.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(cyanomethyl)-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-phenylacetamide
Also Known As: starbld0007333, N-(cyanomethyl)-2-{[4-ethyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-phenylacetamide, N-(Cyanomethyl)-2-((4-ethyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl)thio)-N-phenylacetamide, N-(cyanomethyl)-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-phenylacetamide
| Molecular Formula | C19H18N6OS |
|---|---|
| Molecular Weight | 378.13 g/mol |
| LogP | 3.00888 |
| Topological Polar Surface Area | 87.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 378.12628 |
| Heavy Atoms | 27 |
| Complexity | 935.8387 |
Chemical Identifiers
| CAS Number | 852687-58-2 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)N(CC#N)C2=CC=CC=C2)C3=CC=NC=C3 |
Product Overview
starbld0007333 (CAS 852687-58-2), with molecular formula C19H18N6OS and molecular weight 378.13 g/mol. IUPAC: N-(cyanomethyl)-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-phenylacetamide.
Chemical Property Profile of starbld0007333
Property Insights of starbld0007333
The XLogP value of 3.00888 indicates that starbld0007333 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.7 Ų falls within the moderate polarity range, balancing permeability and solubility for starbld0007333. Following Lipinski's Rule of Five, starbld0007333 has 0 hydrogen bond donor(s) and 6 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 starbld0007333?
The CAS number of starbld0007333 is 852687-58-2.
What is the molecular formula of starbld0007333?
The molecular formula of starbld0007333 is C19H18N6OS.
What is the molecular weight of starbld0007333?
The molecular weight of starbld0007333 is 378.13 g/mol.
Where can I buy starbld0007333?
You can request a quote for starbld0007333 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for starbld0007333?
Yes, KEHONG BIO provides custom synthesis services for starbld0007333 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.