BAS 01313681
TL;DR: BAS 01313681 (CAS 5815-74-7) is a chemical compound with molecular formula C18H19N7OS2 and molecular weight 413.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5-ethyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)acetamide
Also Known As: BAS 01313681, BIM-0034385.P001, 2-[(5-ethyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)acetamide, 2-[(5-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(5-isopropyl-1,3,4-thiadiazol-2-yl)acetamide, 2-[(5-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide
| Molecular Formula | C18H19N7OS2 |
|---|---|
| Molecular Weight | 413.11 g/mol |
| LogP | 3.7051 |
| Topological Polar Surface Area | 98.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 413.10925 |
| Heavy Atoms | 28 |
| Complexity | 1151.467 |
Chemical Identifiers
| CAS Number | 5815-74-7 |
|---|---|
| SMILES | CCN1C2=CC=CC=C2C3=C1N=C(N=N3)SCC(=O)NC4=NN=C(S4)C(C)C |
Product Overview
BAS 01313681 (CAS 5815-74-7), with molecular formula C18H19N7OS2 and molecular weight 413.11 g/mol. IUPAC: 2-[(5-ethyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)acetamide.
Chemical Property Profile of BAS 01313681
Property Insights of BAS 01313681
The XLogP value of 3.7051 indicates that BAS 01313681 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.48 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01313681. Following Lipinski's Rule of Five, BAS 01313681 has 1 hydrogen bond donor(s) and 8 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 01313681?
The CAS number of BAS 01313681 is 5815-74-7.
What is the molecular formula of BAS 01313681?
The molecular formula of BAS 01313681 is C18H19N7OS2.
What is the molecular weight of BAS 01313681?
The molecular weight of BAS 01313681 is 413.11 g/mol.
Where can I buy BAS 01313681?
You can request a quote for BAS 01313681 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01313681?
Yes, KEHONG BIO provides custom synthesis services for BAS 01313681 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.