BAS 00246463
TL;DR: BAS 00246463 (CAS 301358-84-9) is a chemical compound with molecular formula C20H20N2O3S and molecular weight 368.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-methyl-4-(3-phenoxyphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: BAS 00246463, ethyl 6-methyl-4-(3-phenoxyphenyl)-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, ethyl 6-methyl-4-(3-phenoxyphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate, ETHYL 6-METHYL-4-(3-PHENOXYPHENYL)-2-SULFANYLIDENE-1,2,3,4-TETRAHYDROPYRIMIDINE-5-CARBOXYLATE
| Molecular Formula | C20H20N2O3S |
|---|---|
| Molecular Weight | 368.12 g/mol |
| LogP | 3.8348 |
| Topological Polar Surface Area | 59.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 368.11948 |
| Heavy Atoms | 26 |
| Complexity | 849.1446 |
Chemical Identifiers
| CAS Number | 301358-84-9 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC(=S)NC1C2=CC(=CC=C2)OC3=CC=CC=C3)C |
Product Overview
BAS 00246463 (CAS 301358-84-9), with molecular formula C20H20N2O3S and molecular weight 368.12 g/mol. IUPAC: ethyl 6-methyl-4-(3-phenoxyphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of BAS 00246463
Property Insights of BAS 00246463
The XLogP value of 3.8348 indicates that BAS 00246463 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.59 Ų, BAS 00246463 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00246463 has 2 hydrogen bond donor(s) and 4 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 00246463?
The CAS number of BAS 00246463 is 301358-84-9.
What is the molecular formula of BAS 00246463?
The molecular formula of BAS 00246463 is C20H20N2O3S.
What is the molecular weight of BAS 00246463?
The molecular weight of BAS 00246463 is 368.12 g/mol.
Where can I buy BAS 00246463?
You can request a quote for BAS 00246463 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00246463?
Yes, KEHONG BIO provides custom synthesis services for BAS 00246463 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.