Bionet1_000076
TL;DR: Bionet1_000076 (CAS 691868-90-3) is a chemical compound with molecular formula C21H20N2O3S and molecular weight 380.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 8-methyl-6-naphthalen-1-yl-4-oxo-3,6-dihydro-2H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate
Also Known As: Bionet1_000076, MixCom2_000291, ethyl 8-methyl-6-(1-naphthyl)-4-oxo-3,4-dihydro-2H,6H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate, 11R-0270, ethyl 8-methyl-6-(naphthalen-1-yl)-4-oxo-2H,3H,4H,6H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate
| Molecular Formula | C21H20N2O3S |
|---|---|
| Molecular Weight | 380.12 g/mol |
| LogP | 4.0531 |
| Topological Polar Surface Area | 58.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 380.11948 |
| Heavy Atoms | 27 |
| Complexity | 990.58923 |
Chemical Identifiers
| CAS Number | 691868-90-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C2N(C1C3=CC=CC4=CC=CC=C43)C(=O)CCS2)C |
Product Overview
Bionet1_000076 (CAS 691868-90-3), with molecular formula C21H20N2O3S and molecular weight 380.12 g/mol. IUPAC: ethyl 8-methyl-6-naphthalen-1-yl-4-oxo-3,6-dihydro-2H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate.
Chemical Property Profile of Bionet1_000076
Property Insights of Bionet1_000076
The XLogP value of 4.0531 indicates that Bionet1_000076 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.97 Ų, Bionet1_000076 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bionet1_000076 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 Bionet1_000076?
The CAS number of Bionet1_000076 is 691868-90-3.
What is the molecular formula of Bionet1_000076?
The molecular formula of Bionet1_000076 is C21H20N2O3S.
What is the molecular weight of Bionet1_000076?
The molecular weight of Bionet1_000076 is 380.12 g/mol.
Where can I buy Bionet1_000076?
You can request a quote for Bionet1_000076 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_000076?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_000076 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.