BAS 00679716
TL;DR: BAS 00679716 (CAS 5705-98-6) is a chemical compound with molecular formula C16H20N2O6 and molecular weight 336.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: BAS 00679716, BIM-0049196.P001, methyl 4-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate, methyl 4-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate, methyl 4-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
| Molecular Formula | C16H20N2O6 |
|---|---|
| Molecular Weight | 336.13 g/mol |
| LogP | 0.8672 |
| Topological Polar Surface Area | 106.12 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 336.13214 |
| Heavy Atoms | 24 |
| Complexity | 670.5315 |
Chemical Identifiers
| CAS Number | 5705-98-6 |
|---|---|
| SMILES | CC1=C(C(NC(=O)N1)C2=CC(=C(C=C2)OCCO)OC)C(=O)OC |
Product Overview
BAS 00679716 (CAS 5705-98-6), with molecular formula C16H20N2O6 and molecular weight 336.13 g/mol. IUPAC: methyl 4-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of BAS 00679716
Property Insights of BAS 00679716
The XLogP value of 0.8672 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00679716. The TPSA of 106.12 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00679716. Following Lipinski's Rule of Five, BAS 00679716 has 3 hydrogen bond donor(s) and 6 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 00679716?
The CAS number of BAS 00679716 is 5705-98-6.
What is the molecular formula of BAS 00679716?
The molecular formula of BAS 00679716 is C16H20N2O6.
What is the molecular weight of BAS 00679716?
The molecular weight of BAS 00679716 is 336.13 g/mol.
Where can I buy BAS 00679716?
You can request a quote for BAS 00679716 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00679716?
Yes, KEHONG BIO provides custom synthesis services for BAS 00679716 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.