BAS 00486158
TL;DR: BAS 00486158 (CAS 295346-43-9) is a chemical compound with molecular formula C14H16N2O4S and molecular weight 308.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-(4-hydroxy-3-methoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: BAS 00486158, J2.809.261J, methyl 4-(4-hydroxy-3-methoxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, 4-(3-Methoxy-4-hydroxyphenyl)-2-thioxo-6-methyl-1,2,3,4-tetrahydropyrimidine-5-carboxylic acid methyl ester, methyl 4-(4-hydroxy-3-methoxyphenyl)-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
| Molecular Formula | C14H16N2O4S |
|---|---|
| Molecular Weight | 308.08 g/mol |
| LogP | 1.3666 |
| Topological Polar Surface Area | 79.82 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 308.08307 |
| Heavy Atoms | 21 |
| Complexity | 627.4001 |
Chemical Identifiers
| CAS Number | 295346-43-9 |
|---|---|
| SMILES | CC1=C(C(NC(=S)N1)C2=CC(=C(C=C2)O)OC)C(=O)OC |
Product Overview
BAS 00486158 (CAS 295346-43-9), with molecular formula C14H16N2O4S and molecular weight 308.08 g/mol. IUPAC: methyl 4-(4-hydroxy-3-methoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of BAS 00486158
Property Insights of BAS 00486158
The XLogP value of 1.3666 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00486158. The TPSA of 79.82 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00486158. Following Lipinski's Rule of Five, BAS 00486158 has 3 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 00486158?
The CAS number of BAS 00486158 is 295346-43-9.
What is the molecular formula of BAS 00486158?
The molecular formula of BAS 00486158 is C14H16N2O4S.
What is the molecular weight of BAS 00486158?
The molecular weight of BAS 00486158 is 308.08 g/mol.
Where can I buy BAS 00486158?
You can request a quote for BAS 00486158 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00486158?
Yes, KEHONG BIO provides custom synthesis services for BAS 00486158 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.