AB00119807-01
TL;DR: AB00119807-01 (CAS 432501-96-7) is a chemical compound with molecular formula C23H27N5OS and molecular weight 421.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-cyclohexyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-ethylphenyl)acetamide
Also Known As: AB00119807-01, 2-((4-cyclohexyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(4-ethylphenyl)acetamide, 2-[(4-cyclohexyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-ethylphenyl)acetamide, 2-{[4-cyclohexyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-ethylphenyl)acetamide, 2-{[4-CYCLOHEXYL-5-(PYRIDIN-3-YL)-1,2,4-TRIAZOL-3-YL]SULFANYL}-N-(4-ETHYLPHENYL)ACETAMIDE
| Molecular Formula | C23H27N5OS |
|---|---|
| Molecular Weight | 421.19 g/mol |
| LogP | 5.1385 |
| Topological Polar Surface Area | 72.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 421.19363 |
| Heavy Atoms | 30 |
| Complexity | 965.0184 |
Chemical Identifiers
| CAS Number | 432501-96-7 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3CCCCC3)C4=CN=CC=C4 |
Product Overview
AB00119807-01 (CAS 432501-96-7), with molecular formula C23H27N5OS and molecular weight 421.19 g/mol. IUPAC: 2-[(4-cyclohexyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-ethylphenyl)acetamide.
Chemical Property Profile of AB00119807-01
Property Insights of AB00119807-01
The XLogP value of 5.1385 indicates that AB00119807-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.7 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00119807-01. Following Lipinski's Rule of Five, AB00119807-01 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00119807-01?
The CAS number of AB00119807-01 is 432501-96-7.
What is the molecular formula of AB00119807-01?
The molecular formula of AB00119807-01 is C23H27N5OS.
What is the molecular weight of AB00119807-01?
The molecular weight of AB00119807-01 is 421.19 g/mol.
Where can I buy AB00119807-01?
You can request a quote for AB00119807-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00119807-01?
Yes, KEHONG BIO provides custom synthesis services for AB00119807-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.