BAS 01095174
TL;DR: BAS 01095174 (CAS 309293-54-7) is a chemical compound with molecular formula C18H18N4O2S4 and molecular weight 450.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(8-methoxy-4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanone
Also Known As: BAS 01095174, BIM-0034573.P001, A2181/0091650, 1-(8-methoxy-4,4-dimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethanone, 1-(8-methoxy-4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanone
| Molecular Formula | C18H18N4O2S4 |
|---|---|
| Molecular Weight | 450.03 g/mol |
| LogP | 4.71719 |
| Topological Polar Surface Area | 60.25 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 450.03125 |
| Heavy Atoms | 28 |
| Complexity | 1114.9862 |
Chemical Identifiers
| CAS Number | 309293-54-7 |
|---|---|
| SMILES | CC1(C2=C(C3=C(N1C(=O)CSC4=NN=CN4C)C=CC(=C3)OC)C(=S)SS2)C |
Product Overview
BAS 01095174 (CAS 309293-54-7), with molecular formula C18H18N4O2S4 and molecular weight 450.03 g/mol. IUPAC: 1-(8-methoxy-4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanone.
Chemical Property Profile of BAS 01095174
Property Insights of BAS 01095174
The XLogP value of 4.71719 indicates that BAS 01095174 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.25 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01095174. Following Lipinski's Rule of Five, BAS 01095174 has 0 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 01095174?
The CAS number of BAS 01095174 is 309293-54-7.
What is the molecular formula of BAS 01095174?
The molecular formula of BAS 01095174 is C18H18N4O2S4.
What is the molecular weight of BAS 01095174?
The molecular weight of BAS 01095174 is 450.03 g/mol.
Where can I buy BAS 01095174?
You can request a quote for BAS 01095174 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01095174?
Yes, KEHONG BIO provides custom synthesis services for BAS 01095174 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.