ASN 13558628
TL;DR: ASN 13558628 (CAS 886181-24-4) is a chemical compound with molecular formula C18H22N6O2S and molecular weight 386.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-[(4-prop-2-enyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]piperidine-4-carboxamide
Also Known As: ASN 13558628, 1-(((4-(2-propen-1-yl)-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl)sulfanyl)acetyl)-4-piperidinecarboxamide, 1-({[4-(prop-2-en-1-yl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)piperidine-4-carboxamide, 1-(2-((4-allyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl)thio)acetyl)piperidine-4-carboxamide, 1-(2-{[4-(PROP-2-EN-1-YL)-5-(PYRIDIN-3-YL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}ACETYL)PIPERIDINE-4-CARBOXAMIDE
| Molecular Formula | C18H22N6O2S |
|---|---|
| Molecular Weight | 386.15 g/mol |
| LogP | 1.3421 |
| Topological Polar Surface Area | 107.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 386.1525 |
| Heavy Atoms | 27 |
| Complexity | 814.5143 |
Chemical Identifiers
| CAS Number | 886181-24-4 |
|---|---|
| SMILES | C=CCN1C(=NN=C1SCC(=O)N2CCC(CC2)C(=O)N)C3=CN=CC=C3 |
Product Overview
ASN 13558628 (CAS 886181-24-4), with molecular formula C18H22N6O2S and molecular weight 386.15 g/mol. IUPAC: 1-[2-[(4-prop-2-enyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]piperidine-4-carboxamide.
Chemical Property Profile of ASN 13558628
Property Insights of ASN 13558628
The XLogP value of 1.3421 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ASN 13558628. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ASN 13558628. Following Lipinski's Rule of Five, ASN 13558628 has 1 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 ASN 13558628?
The CAS number of ASN 13558628 is 886181-24-4.
What is the molecular formula of ASN 13558628?
The molecular formula of ASN 13558628 is C18H22N6O2S.
What is the molecular weight of ASN 13558628?
The molecular weight of ASN 13558628 is 386.15 g/mol.
Where can I buy ASN 13558628?
You can request a quote for ASN 13558628 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ASN 13558628?
Yes, KEHONG BIO provides custom synthesis services for ASN 13558628 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.