BAS 00776008
TL;DR: BAS 00776008 (CAS 300770-29-0) is a chemical compound with molecular formula C17H17ClN2O3S and molecular weight 364.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-(2-chlorophenyl)-8-methyl-4-oxo-3,6-dihydro-2H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate
Also Known As: BAS 00776008, ethyl 6-(2-chlorophenyl)-8-methyl-4-oxo-2H,3H,4H,6H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate, ethyl 6-(2-chlorophenyl)-8-methyl-4-oxo-3,4-dihydro-2H,6H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate, ethyl 6-(2-chlorophenyl)-8-methyl-4-oxo-3,6-dihydro-2H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate
| Molecular Formula | C17H17ClN2O3S |
|---|---|
| Molecular Weight | 364.06 g/mol |
| LogP | 3.5533 |
| Topological Polar Surface Area | 58.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 364.06485 |
| Heavy Atoms | 24 |
| Complexity | 759.95746 |
Chemical Identifiers
| CAS Number | 300770-29-0 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3Cl)C(=O)CCS2)C |
Product Overview
BAS 00776008 (CAS 300770-29-0), with molecular formula C17H17ClN2O3S and molecular weight 364.06 g/mol. IUPAC: ethyl 6-(2-chlorophenyl)-8-methyl-4-oxo-3,6-dihydro-2H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate.
Chemical Property Profile of BAS 00776008
Property Insights of BAS 00776008
The XLogP value of 3.5533 indicates that BAS 00776008 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.97 Ų, BAS 00776008 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00776008 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 00776008?
The CAS number of BAS 00776008 is 300770-29-0.
What is the molecular formula of BAS 00776008?
The molecular formula of BAS 00776008 is C17H17ClN2O3S.
What is the molecular weight of BAS 00776008?
The molecular weight of BAS 00776008 is 364.06 g/mol.
Where can I buy BAS 00776008?
You can request a quote for BAS 00776008 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00776008?
Yes, KEHONG BIO provides custom synthesis services for BAS 00776008 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.