BAS 00619649
TL;DR: BAS 00619649 (CAS 114483-51-1) is a chemical compound with molecular formula C21H22N2O3S and molecular weight 382.1351 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 6-methyl-4-(2-phenylmethoxyphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: BAS 00619649, ethyl 4-[2-(benzyloxy)phenyl]-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate, ethyl 4-[2-(benzyloxy)phenyl]-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, ethyl 6-methyl-4-(2-phenylmethoxyphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate, ethyl 4-(2-(benzyloxy)phenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Technical Specifications
| Molecular Formula | C21H22N2O3S |
| Molecular Weight | 382.1351 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 91.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 382.1351 Da |
| Heavy Atoms | 27 |
| Complexity | 572.0 |
| SMILES | CCOC(=O)C1=C(NC(=S)NC1C2=CC=CC=C2OCC3=CC=CC=C3)C |
| InChIKey | GFGXZWJCWCLHKF-UHFFFAOYSA-N |
Chemical Property Profile of BAS 00619649
Property Insights of BAS 00619649
The XLogP value of 3.4 indicates that BAS 00619649 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.7 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00619649. Following Lipinski's Rule of Five, BAS 00619649 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
What is the CAS number of BAS 00619649?
The CAS number of BAS 00619649 is 114483-51-1.
What is the molecular formula of BAS 00619649?
The molecular formula of BAS 00619649 is C21H22N2O3S.
What is the molecular weight of BAS 00619649?
The molecular weight of BAS 00619649 is 382.1351 g/mol.
Where can I buy BAS 00619649?
You can request a quote for BAS 00619649 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for BAS 00619649?
Yes, CoreyChem provides custom synthesis services for BAS 00619649 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.