BAS 02993398
TL;DR: BAS 02993398 (CAS 412922-91-9) is a chemical compound with molecular formula C18H19N5O3S and molecular weight 385.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,5-dimethoxyphenyl)-2-[(4-methyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
Also Known As: BAS 02993398, N-(2,5-dimethoxyphenyl)-2-(4-methyl-5-(3-pyridyl)(1,2,4-triazol-3-ylthio))acet amide, N-(2,5-dimethoxyphenyl)-2-[(4-methyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide, N-(2,5-DIMETHOXYPHENYL)-2-{[4-METHYL-5-(3-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}ACETAMIDE, N-(2,5-dimethoxyphenyl)-2-{[4-methyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
| Molecular Formula | C18H19N5O3S |
|---|---|
| Molecular Weight | 385.12 g/mol |
| LogP | 2.6251 |
| Topological Polar Surface Area | 91.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 385.12085 |
| Heavy Atoms | 27 |
| Complexity | 930.00146 |
Chemical Identifiers
| CAS Number | 412922-91-9 |
|---|---|
| SMILES | CN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)OC)OC)C3=CN=CC=C3 |
Product Overview
BAS 02993398 (CAS 412922-91-9), with molecular formula C18H19N5O3S and molecular weight 385.12 g/mol. IUPAC: N-(2,5-dimethoxyphenyl)-2-[(4-methyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide.
Chemical Property Profile of BAS 02993398
Property Insights of BAS 02993398
The XLogP value of 2.6251 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 02993398. The TPSA of 91.16 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02993398. Following Lipinski's Rule of Five, BAS 02993398 has 1 hydrogen bond donor(s) and 7 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 BAS 02993398?
The CAS number of BAS 02993398 is 412922-91-9.
What is the molecular formula of BAS 02993398?
The molecular formula of BAS 02993398 is C18H19N5O3S.
What is the molecular weight of BAS 02993398?
The molecular weight of BAS 02993398 is 385.12 g/mol.
Where can I buy BAS 02993398?
You can request a quote for BAS 02993398 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02993398?
Yes, KEHONG BIO provides custom synthesis services for BAS 02993398 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.