BAS 01051868
TL;DR: BAS 01051868 (CAS 5614-05-1) is a chemical compound with molecular formula C16H17F3N2O5 and molecular weight 374.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,2-trifluoroethyl 4-(3,4-dimethoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: BAS 01051868, AB00090539-01, 2,2,2-trifluoroethyl 4-(3,4-dimethoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, 2,2,2-trifluoroethyl 4-(3,4-dimethoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate, 2,2,2-trifluoroethyl 4-(3,4-dimethoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
| Molecular Formula | C16H17F3N2O5 |
|---|---|
| Molecular Weight | 374.11 g/mol |
| LogP | 2.4372 |
| Topological Polar Surface Area | 85.89 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 374.10895 |
| Heavy Atoms | 26 |
| Complexity | 745.89105 |
Chemical Identifiers
| CAS Number | 5614-05-1 |
|---|---|
| SMILES | CC1=C(C(NC(=O)N1)C2=CC(=C(C=C2)OC)OC)C(=O)OCC(F)(F)F |
Product Overview
BAS 01051868 (CAS 5614-05-1), with molecular formula C16H17F3N2O5 and molecular weight 374.11 g/mol. IUPAC: 2,2,2-trifluoroethyl 4-(3,4-dimethoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of BAS 01051868
Property Insights of BAS 01051868
The XLogP value of 2.4372 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 01051868. The TPSA of 85.89 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01051868. Following Lipinski's Rule of Five, BAS 01051868 has 2 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 01051868?
The CAS number of BAS 01051868 is 5614-05-1.
What is the molecular formula of BAS 01051868?
The molecular formula of BAS 01051868 is C16H17F3N2O5.
What is the molecular weight of BAS 01051868?
The molecular weight of BAS 01051868 is 374.11 g/mol.
Where can I buy BAS 01051868?
You can request a quote for BAS 01051868 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01051868?
Yes, KEHONG BIO provides custom synthesis services for BAS 01051868 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.