BAS 12969623
TL;DR: BAS 12969623 (CAS 878427-85-1) is a chemical compound with molecular formula C19H20N2O5S and molecular weight 388.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-bis(2-methoxyphenyl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d]imidazol-2-one
Also Known As: BAS 12969623, 1,3-bis(2-methoxyphenyl)tetrahydro-1H-thieno[3,4-d]imidazol-2(3H)-one 5,5-dioxide, VU0509475-1, VU0509475-2, AB00682937-01
| Molecular Formula | C19H20N2O5S |
|---|---|
| Molecular Weight | 388.11 g/mol |
| LogP | 2.316 |
| Topological Polar Surface Area | 76.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 388.10928 |
| Heavy Atoms | 27 |
| Complexity | 919.5995 |
Chemical Identifiers
| CAS Number | 878427-85-1 |
|---|---|
| SMILES | COC1=CC=CC=C1N2C3CS(=O)(=O)CC3N(C2=O)C4=CC=CC=C4OC |
Product Overview
BAS 12969623 (CAS 878427-85-1), with molecular formula C19H20N2O5S and molecular weight 388.11 g/mol. IUPAC: 1,3-bis(2-methoxyphenyl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d]imidazol-2-one.
Chemical Property Profile of BAS 12969623
Property Insights of BAS 12969623
The XLogP value of 2.316 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 12969623. The TPSA of 76.15 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12969623. Following Lipinski's Rule of Five, BAS 12969623 has 0 hydrogen bond donor(s) and 5 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 12969623?
The CAS number of BAS 12969623 is 878427-85-1.
What is the molecular formula of BAS 12969623?
The molecular formula of BAS 12969623 is C19H20N2O5S.
What is the molecular weight of BAS 12969623?
The molecular weight of BAS 12969623 is 388.11 g/mol.
Where can I buy BAS 12969623?
You can request a quote for BAS 12969623 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12969623?
Yes, KEHONG BIO provides custom synthesis services for BAS 12969623 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.