BAS 00288900
TL;DR: BAS 00288900 (CAS 330819-65-3) is a chemical compound with molecular formula C13H14N4OS3 and molecular weight 338.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
14,14-dimethyl-7-methylsulfanyl-13-oxa-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,7,11(16)-tetraene-5-thione
Also Known As: BAS 00288900, 10,10-dimethyl-5-(methylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine-3(2H)-thione, 10,10-dimethyl-5-(methylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thiol, 10,10-dimethyl-5-(methylthio)-10,11-dihydro-2H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine-3(8H)-thione
| Molecular Formula | C13H14N4OS3 |
|---|---|
| Molecular Weight | 338.03 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 135.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 338.033 |
| Heavy Atoms | 21 |
| Complexity | 562.0 |
Chemical Identifiers
| CAS Number | 330819-65-3 |
|---|---|
| SMILES | CC1(CC2=C(CO1)SC3=C2C4=NNC(=S)N4C(=N3)SC)C |
| InChIKey | WCAMZIJBSZBOFO-UHFFFAOYSA-N |
Product Overview
BAS 00288900 (CAS 330819-65-3), with molecular formula C13H14N4OS3 and molecular weight 338.03 g/mol. IUPAC: 14,14-dimethyl-7-methylsulfanyl-13-oxa-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,7,11(16)-tetraene-5-thione.
Chemical Property Profile of BAS 00288900
Property Insights of BAS 00288900
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00288900. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00288900. Following Lipinski's Rule of Five, BAS 00288900 has 1 hydrogen bond donor(s) and 6 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 00288900?
The CAS number of BAS 00288900 is 330819-65-3.
What is the molecular formula of BAS 00288900?
The molecular formula of BAS 00288900 is C13H14N4OS3.
What is the molecular weight of BAS 00288900?
The molecular weight of BAS 00288900 is 338.03 g/mol.
Where can I buy BAS 00288900?
You can request a quote for BAS 00288900 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00288900?
Yes, KEHONG BIO provides custom synthesis services for BAS 00288900 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.