BAS 04246222
TL;DR: BAS 04246222 (CAS 309734-94-9) is a chemical compound with molecular formula C14H11N3O2S and molecular weight 285.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(4-methoxyphenyl)-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carbonitrile
Also Known As: BAS 04246222, A2254/0094933, 7-(4-methoxyphenyl)-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carbonitrile, 5H-Thiazolo[3,2-a]pyrimidine-6-carbonitrile, 2,3-dihydro-7-(4-methoxyphenyl)-5-oxo-, 7-(4-Methoxyphenyl)-5-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carbonitrile
| Molecular Formula | C14H11N3O2S |
|---|---|
| Molecular Weight | 285.06 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 91.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 285.0572 |
| Heavy Atoms | 20 |
| Complexity | 538.0 |
Chemical Identifiers
| CAS Number | 309734-94-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=C(C(=O)N3CCSC3=N2)C#N |
| InChIKey | CMJRGUXJJMUYHH-UHFFFAOYSA-N |
Product Overview
BAS 04246222 (CAS 309734-94-9), with molecular formula C14H11N3O2S and molecular weight 285.06 g/mol. IUPAC: 7-(4-methoxyphenyl)-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carbonitrile.
Chemical Property Profile of BAS 04246222
Property Insights of BAS 04246222
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 04246222. The TPSA of 91.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 04246222. Following Lipinski's Rule of Five, BAS 04246222 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 04246222?
The CAS number of BAS 04246222 is 309734-94-9.
What is the molecular formula of BAS 04246222?
The molecular formula of BAS 04246222 is C14H11N3O2S.
What is the molecular weight of BAS 04246222?
The molecular weight of BAS 04246222 is 285.06 g/mol.
Where can I buy BAS 04246222?
You can request a quote for BAS 04246222 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04246222?
Yes, KEHONG BIO provides custom synthesis services for BAS 04246222 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.