BAS 01916019
TL;DR: BAS 01916019 (CAS 332934-55-1) is a chemical compound with molecular formula C19H18ClN5O3S and molecular weight 431.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methyl-3-nitrophenyl)acetamide
Also Known As: BAS 01916019, 2-[[5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methyl-3-nitrophenyl)acetamide, 2-{[5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methyl-3-nitrophenyl)acetamide
| Molecular Formula | C19H18ClN5O3S |
|---|---|
| Molecular Weight | 431.08 g/mol |
| LogP | 4.56582 |
| Topological Polar Surface Area | 102.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 431.08188 |
| Heavy Atoms | 29 |
| Complexity | 1052.4982 |
Chemical Identifiers
| CAS Number | 332934-55-1 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)NC2=CC(=C(C=C2)C)[N+](=O)[O-])C3=CC=C(C=C3)Cl |
Product Overview
BAS 01916019 (CAS 332934-55-1), with molecular formula C19H18ClN5O3S and molecular weight 431.08 g/mol. IUPAC: 2-[[5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methyl-3-nitrophenyl)acetamide.
Chemical Property Profile of BAS 01916019
Property Insights of BAS 01916019
The XLogP value of 4.56582 indicates that BAS 01916019 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.95 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01916019. Following Lipinski's Rule of Five, BAS 01916019 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 BAS 01916019?
The CAS number of BAS 01916019 is 332934-55-1.
What is the molecular formula of BAS 01916019?
The molecular formula of BAS 01916019 is C19H18ClN5O3S.
What is the molecular weight of BAS 01916019?
The molecular weight of BAS 01916019 is 431.08 g/mol.
Where can I buy BAS 01916019?
You can request a quote for BAS 01916019 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01916019?
Yes, KEHONG BIO provides custom synthesis services for BAS 01916019 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.