AB00770359-01
TL;DR: AB00770359-01 (CAS 925079-82-9) is a chemical compound with molecular formula C18H21N5OS and molecular weight 355.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-ethyl-2,5-dimethylpyrrol-3-yl)-2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone
Also Known As: AB00770359-01, 1-(1-ethyl-2,5-dimethyl-1H-pyrrol-3-yl)-2-{[4-methyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone, 1-(1-ethyl-2,5-dimethylpyrrol-3-yl)-2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone, 1-(1-ethyl-2,5-dimethyl-1H-pyrrol-3-yl)-2-((4-methyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl)thio)ethanone
| Molecular Formula | C18H21N5OS |
|---|---|
| Molecular Weight | 355.15 g/mol |
| LogP | 3.29034 |
| Topological Polar Surface Area | 65.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 355.14667 |
| Heavy Atoms | 25 |
| Complexity | 897.8347 |
Chemical Identifiers
| CAS Number | 925079-82-9 |
|---|---|
| SMILES | CCN1C(=CC(=C1C)C(=O)CSC2=NN=C(N2C)C3=CC=NC=C3)C |
Product Overview
AB00770359-01 (CAS 925079-82-9), with molecular formula C18H21N5OS and molecular weight 355.15 g/mol. IUPAC: 1-(1-ethyl-2,5-dimethylpyrrol-3-yl)-2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone.
Chemical Property Profile of AB00770359-01
Property Insights of AB00770359-01
The XLogP value of 3.29034 indicates that AB00770359-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.6 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00770359-01. Following Lipinski's Rule of Five, AB00770359-01 has 0 hydrogen bond donor(s) and 5 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 AB00770359-01?
The CAS number of AB00770359-01 is 925079-82-9.
What is the molecular formula of AB00770359-01?
The molecular formula of AB00770359-01 is C18H21N5OS.
What is the molecular weight of AB00770359-01?
The molecular weight of AB00770359-01 is 355.15 g/mol.
Where can I buy AB00770359-01?
You can request a quote for AB00770359-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00770359-01?
Yes, KEHONG BIO provides custom synthesis services for AB00770359-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.