BAS 01313688
TL;DR: BAS 01313688 (CAS 296898-02-7) is a chemical compound with molecular formula C19H18N6O3S2 and molecular weight 442.0882 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(5-ethyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(4-sulfamoylphenyl)acetamide
Also Known As: BAS 01313688, IDI1_002248, 2-[(5-ethyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(4-sulfamoylphenyl)acetamide, 2-[(5-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(4-sulfamoylphenyl)acetamide, 2-({5-ETHYL-[1,2,4]TRIAZINO[5,6-B]INDOL-3-YL}SULFANYL)-N-(4-SULFAMOYLPHENYL)ACETAMIDE
Technical Specifications
| Molecular Formula | C19H18N6O3S2 |
| Molecular Weight | 442.0882 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 167.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 442.0882 Da |
| Heavy Atoms | 30 |
| Complexity | 710.0 |
| SMILES | CCN1C2=CC=CC=C2C3=C1N=C(N=N3)SCC(=O)NC4=CC=C(C=C4)S(=O)(=O)N |
| InChIKey | XFILTIALQLCBFL-UHFFFAOYSA-N |
Chemical Property Profile of BAS 01313688
Property Insights of BAS 01313688
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 01313688. The TPSA of 167.0 Ų indicates high polarity, suggesting BAS 01313688 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, BAS 01313688 has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of BAS 01313688?
The CAS number of BAS 01313688 is 296898-02-7.
What is the molecular formula of BAS 01313688?
The molecular formula of BAS 01313688 is C19H18N6O3S2.
What is the molecular weight of BAS 01313688?
The molecular weight of BAS 01313688 is 442.0882 g/mol.
Where can I buy BAS 01313688?
You can request a quote for BAS 01313688 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for BAS 01313688?
Yes, CoreyChem provides custom synthesis services for BAS 01313688 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.