BAS 06105671
TL;DR: BAS 06105671 (CAS 312946-70-6) is a chemical compound with molecular formula C16H14N2OS and molecular weight 282.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11-(4-methylphenyl)-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one
Also Known As: BAS 06105671, AB00333031-03, 3-(4-methylphenyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one, 5-p-Tolyl-1,2,3,5-tetrahydro-8-thia-5,7-diaza-cyclopenta[a]inden-4-one, 2-(4-methylphenyl)-7,8-dihydro-6H-cyclopenta[2,3]thieno[2,4-d]pyrimidin-1-one
| Molecular Formula | C16H14N2OS |
|---|---|
| Molecular Weight | 282.08 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 60.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 282.08267 |
| Heavy Atoms | 20 |
| Complexity | 430.0 |
Chemical Identifiers
| CAS Number | 312946-70-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C=NC3=C(C2=O)C4=C(S3)CCC4 |
| InChIKey | WIGFGONVXFUZLO-UHFFFAOYSA-N |
Product Overview
BAS 06105671 (CAS 312946-70-6), with molecular formula C16H14N2OS and molecular weight 282.08 g/mol. IUPAC: 11-(4-methylphenyl)-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one.
Chemical Property Profile of BAS 06105671
Property Insights of BAS 06105671
The XLogP value of 3.5 indicates that BAS 06105671 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.9 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 06105671. Following Lipinski's Rule of Five, BAS 06105671 has 0 hydrogen bond donor(s) and 3 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 06105671?
The CAS number of BAS 06105671 is 312946-70-6.
What is the molecular formula of BAS 06105671?
The molecular formula of BAS 06105671 is C16H14N2OS.
What is the molecular weight of BAS 06105671?
The molecular weight of BAS 06105671 is 282.08 g/mol.
Where can I buy BAS 06105671?
You can request a quote for BAS 06105671 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06105671?
Yes, KEHONG BIO provides custom synthesis services for BAS 06105671 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.