AB00122225-01
TL;DR: AB00122225-01 (CAS 304450-94-0) is a chemical compound with molecular formula C19H26N2O3S and molecular weight 362.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethylsulfanylethyl 6-methyl-2-oxo-4-(4-propan-2-ylphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: AB00122225-01, A2965/0124878, 2-(ethylsulfanyl)ethyl 6-methyl-2-oxo-4-[4-(propan-2-yl)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate, 2-(ethylthio)ethyl 4-(4-isopropylphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, 2-ethylsulfanylethyl 6-methyl-2-oxo-4-(4-propan-2-ylphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate
| Molecular Formula | C19H26N2O3S |
|---|---|
| Molecular Weight | 362.17 g/mol |
| LogP | 3.7342 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 362.1664 |
| Heavy Atoms | 25 |
| Complexity | 653.138 |
Chemical Identifiers
| CAS Number | 304450-94-0 |
|---|---|
| SMILES | CCSCCOC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)C(C)C)C |
Product Overview
AB00122225-01 (CAS 304450-94-0), with molecular formula C19H26N2O3S and molecular weight 362.17 g/mol. IUPAC: 2-ethylsulfanylethyl 6-methyl-2-oxo-4-(4-propan-2-ylphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of AB00122225-01
Property Insights of AB00122225-01
The XLogP value of 3.7342 indicates that AB00122225-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00122225-01. Following Lipinski's Rule of Five, AB00122225-01 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 AB00122225-01?
The CAS number of AB00122225-01 is 304450-94-0.
What is the molecular formula of AB00122225-01?
The molecular formula of AB00122225-01 is C19H26N2O3S.
What is the molecular weight of AB00122225-01?
The molecular weight of AB00122225-01 is 362.17 g/mol.
Where can I buy AB00122225-01?
You can request a quote for AB00122225-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00122225-01?
Yes, KEHONG BIO provides custom synthesis services for AB00122225-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.