RefChem:554837
TL;DR: RefChem:554837 (CAS 618075-57-3) is a chemical compound with molecular formula C18H17FN2O3S and molecular weight 360.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
prop-2-enyl 6-(3-fluorophenyl)-8-methyl-4-oxo-3,6-dihydro-2H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate
Also Known As: BAS 06261511, ALLYL 6-(3-FLUOROPHENYL)-8-METHYL-4-OXO-3,4-DIHYDRO-2H,6H-PYRIMIDO[2,1-B][1,3]THIAZINE-7-CARBOXYLATE, 645-581-7, Allyl 6-(3-fluorophenyl)-8-methyl-4-oxo-2,3,4,6-tetrahydropyrimido[2,1-b][1,3]thiazine-7-carboxylate, ALLYL 6-(3-FLUOROPHENYL)-8-METHYL-4-OXO-3,4-DIHYDRO-2H,6H-PYRIMIDO(2,1-B)(1,3)THIAZINE-7-CARBOXYLATE
| Molecular Formula | C18H17FN2O3S |
|---|---|
| Molecular Weight | 360.09 g/mol |
| LogP | 3.2051 |
| Topological Polar Surface Area | 58.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 360.0944 |
| Heavy Atoms | 25 |
| Complexity | 803.26587 |
Chemical Identifiers
| CAS Number | 618075-57-3 |
|---|---|
| SMILES | CC1=C(C(N2C(=O)CCSC2=N1)C3=CC(=CC=C3)F)C(=O)OCC=C |
Product Overview
RefChem:554837 (CAS 618075-57-3), with molecular formula C18H17FN2O3S and molecular weight 360.09 g/mol. IUPAC: prop-2-enyl 6-(3-fluorophenyl)-8-methyl-4-oxo-3,6-dihydro-2H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate.
Chemical Property Profile of RefChem:554837
Property Insights of RefChem:554837
The XLogP value of 3.2051 indicates that RefChem:554837 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.97 Ų, RefChem:554837 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:554837 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 RefChem:554837?
The CAS number of RefChem:554837 is 618075-57-3.
What is the molecular formula of RefChem:554837?
The molecular formula of RefChem:554837 is C18H17FN2O3S.
What is the molecular weight of RefChem:554837?
The molecular weight of RefChem:554837 is 360.09 g/mol.
Where can I buy RefChem:554837?
You can request a quote for RefChem:554837 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:554837?
Yes, KEHONG BIO provides custom synthesis services for RefChem:554837 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.