BAS 05290800
TL;DR: BAS 05290800 (CAS 446278-63-3) is a chemical compound with molecular formula C15H16N2O4S2 and molecular weight 352.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 14-hydroxy-16-oxo-8,12-dithia-10,15-diazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(9),2(7),10-triene-14-carboxylate
Also Known As: BAS 05290800, AF-399/41110638, ethyl 3-hydroxy-5-oxo-4,6,7,8,9-pentahydro-2H-benzo[b]thiopheno[2,3-d]1,3-thia zolidino[3,2-a]pyrimidine-3-carboxylate, ethyl 3-hydroxy-5-oxo-2,3,6,7,8,9-hexahydro-5H-[1]benzothieno[2,3-d][1,3]thiazolo[3,2-a]pyrimidine-3-carboxylate
| Molecular Formula | C15H16N2O4S2 |
|---|---|
| Molecular Weight | 352.06 g/mol |
| LogP | 1.6507 |
| Topological Polar Surface Area | 81.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 352.05515 |
| Heavy Atoms | 23 |
| Complexity | 872.46454 |
Chemical Identifiers
| CAS Number | 446278-63-3 |
|---|---|
| SMILES | CCOC(=O)C1(CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N21)O |
Product Overview
BAS 05290800 (CAS 446278-63-3), with molecular formula C15H16N2O4S2 and molecular weight 352.06 g/mol. IUPAC: ethyl 14-hydroxy-16-oxo-8,12-dithia-10,15-diazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(9),2(7),10-triene-14-carboxylate.
Chemical Property Profile of BAS 05290800
Property Insights of BAS 05290800
The XLogP value of 1.6507 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 05290800. The TPSA of 81.42 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 05290800. Following Lipinski's Rule of Five, BAS 05290800 has 1 hydrogen bond donor(s) and 7 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 05290800?
The CAS number of BAS 05290800 is 446278-63-3.
What is the molecular formula of BAS 05290800?
The molecular formula of BAS 05290800 is C15H16N2O4S2.
What is the molecular weight of BAS 05290800?
The molecular weight of BAS 05290800 is 352.06 g/mol.
Where can I buy BAS 05290800?
You can request a quote for BAS 05290800 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 05290800?
Yes, KEHONG BIO provides custom synthesis services for BAS 05290800 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.