BAS 10121876
TL;DR: BAS 10121876 (CAS 876710-30-4) is a chemical compound with molecular formula C14H16N4S and molecular weight 272.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
15-ethyl-9-thia-11,13,14,16-tetrazatetracyclo[8.7.0.02,8.013,17]heptadeca-1(10),2(8),11,14,16-pentaene
Also Known As: BAS 10121876, 2-ethyl-9,10,11,12-tetrahydro-8H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
| Molecular Formula | C14H16N4S |
|---|---|
| Molecular Weight | 272.11 g/mol |
| LogP | 3.1703 |
| Topological Polar Surface Area | 43.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 272.10956 |
| Heavy Atoms | 19 |
| Complexity | 755.567 |
Chemical Identifiers
| CAS Number | 876710-30-4 |
|---|---|
| SMILES | CCC1=NN2C=NC3=C(C2=N1)C4=C(S3)CCCCC4 |
Product Overview
BAS 10121876 (CAS 876710-30-4), with molecular formula C14H16N4S and molecular weight 272.11 g/mol. IUPAC: 15-ethyl-9-thia-11,13,14,16-tetrazatetracyclo[8.7.0.02,8.013,17]heptadeca-1(10),2(8),11,14,16-pentaene.
Chemical Property Profile of BAS 10121876
Property Insights of BAS 10121876
The XLogP value of 3.1703 indicates that BAS 10121876 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.08 Ų, BAS 10121876 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 10121876 has 0 hydrogen bond donor(s) and 4 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 10121876?
The CAS number of BAS 10121876 is 876710-30-4.
What is the molecular formula of BAS 10121876?
The molecular formula of BAS 10121876 is C14H16N4S.
What is the molecular weight of BAS 10121876?
The molecular weight of BAS 10121876 is 272.11 g/mol.
Where can I buy BAS 10121876?
You can request a quote for BAS 10121876 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 10121876?
Yes, KEHONG BIO provides custom synthesis services for BAS 10121876 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.