BAS 01258566
TL;DR: BAS 01258566 (CAS 337351-75-4) is a chemical compound with molecular formula C17H16N2OS2 and molecular weight 328.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11-(4-methylphenyl)-10-methylsulfanyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one
Also Known As: BAS 01258566, AJ-292/13049075, 3-(4-methylphenyl)-2-(methylsulfanyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one, 11-(4-Methylphenyl)-10-methylsulfanyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one, 2-(4-methylphenyl)-3-methylsulfanyl-7,8-dihydro-6H-cyclopenta[2,3]thieno[2,4-b]pyrimidin-1-one
| Molecular Formula | C17H16N2OS2 |
|---|---|
| Molecular Weight | 328.07 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 86.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 328.0704 |
| Heavy Atoms | 22 |
| Complexity | 487.0 |
Chemical Identifiers
| CAS Number | 337351-75-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SC)SC4=C3CCC4 |
| InChIKey | DDXPEKZUCFDDTL-UHFFFAOYSA-N |
Product Overview
BAS 01258566 (CAS 337351-75-4), with molecular formula C17H16N2OS2 and molecular weight 328.07 g/mol. IUPAC: 11-(4-methylphenyl)-10-methylsulfanyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one.
Chemical Property Profile of BAS 01258566
Property Insights of BAS 01258566
The XLogP value of 4.4 indicates that BAS 01258566 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.2 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01258566. Following Lipinski's Rule of Five, BAS 01258566 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 01258566?
The CAS number of BAS 01258566 is 337351-75-4.
What is the molecular formula of BAS 01258566?
The molecular formula of BAS 01258566 is C17H16N2OS2.
What is the molecular weight of BAS 01258566?
The molecular weight of BAS 01258566 is 328.07 g/mol.
Where can I buy BAS 01258566?
You can request a quote for BAS 01258566 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01258566?
Yes, KEHONG BIO provides custom synthesis services for BAS 01258566 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.