BAS 00085185
TL;DR: BAS 00085185 (CAS 331255-79-9) is a chemical compound with molecular formula C15H17N3O3S and molecular weight 319.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-acetyl-N-(2-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)acetamide
Also Known As: BAS 00085185, AH-262/34334003, N-acetyl-N-(2-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)acetamide, N-Acetyl-N-(2-methyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetamide, 2-(Diacetylamino)-6,7,8,9-tetrahydro-3-methylbenzo[4,5]thieno[2,3-d]pyrimidin-1(2H)-one
| Molecular Formula | C15H17N3O3S |
|---|---|
| Molecular Weight | 319.10 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 98.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 319.09906 |
| Heavy Atoms | 22 |
| Complexity | 548.0 |
Chemical Identifiers
| CAS Number | 331255-79-9 |
|---|---|
| SMILES | CC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1N(C(=O)C)C(=O)C |
| InChIKey | ULHIHGRSVCYUQR-UHFFFAOYSA-N |
Product Overview
BAS 00085185 (CAS 331255-79-9), with molecular formula C15H17N3O3S and molecular weight 319.10 g/mol. IUPAC: N-acetyl-N-(2-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)acetamide.
Chemical Property Profile of BAS 00085185
Property Insights of BAS 00085185
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00085185. The TPSA of 98.3 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00085185. Following Lipinski's Rule of Five, BAS 00085185 has 0 hydrogen bond donor(s) and 5 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 00085185?
The CAS number of BAS 00085185 is 331255-79-9.
What is the molecular formula of BAS 00085185?
The molecular formula of BAS 00085185 is C15H17N3O3S.
What is the molecular weight of BAS 00085185?
The molecular weight of BAS 00085185 is 319.10 g/mol.
Where can I buy BAS 00085185?
You can request a quote for BAS 00085185 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00085185?
Yes, KEHONG BIO provides custom synthesis services for BAS 00085185 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.