AO-022/43455436
TL;DR: AO-022/43455436 (CAS 836643-11-9) is a chemical compound with molecular formula C19H21BrN2O3S and molecular weight 436.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylpropyl 5-(4-bromophenyl)-2,7-dimethyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Also Known As: AO-022/43455436, isobutyl 5-(4-bromophenyl)-2,7-dimethyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, 2-methylpropyl 5-(4-bromophenyl)-2,7-dimethyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, 2-METHYLPROPYL 5-(4-BROMOPHENYL)-2,7-DIMETHYL-3-OXO-2H,3H,5H-[1,3]THIAZOLO[3,2-A]PYRIMIDINE-6-CARBOXYLATE, 2-methylpropyl 5-(4-bromophenyl)-2,7-dimethyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
| Molecular Formula | C19H21BrN2O3S |
|---|---|
| Molecular Weight | 436.05 g/mol |
| LogP | 4.2969 |
| Topological Polar Surface Area | 58.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 436.04562 |
| Heavy Atoms | 26 |
| Complexity | 801.5072 |
Chemical Identifiers
| CAS Number | 836643-11-9 |
|---|---|
| SMILES | CC1C(=O)N2C(C(=C(N=C2S1)C)C(=O)OCC(C)C)C3=CC=C(C=C3)Br |
Product Overview
AO-022/43455436 (CAS 836643-11-9), with molecular formula C19H21BrN2O3S and molecular weight 436.05 g/mol. IUPAC: 2-methylpropyl 5-(4-bromophenyl)-2,7-dimethyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.
Chemical Property Profile of AO-022/43455436
Property Insights of AO-022/43455436
The XLogP value of 4.2969 indicates that AO-022/43455436 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.97 Ų, AO-022/43455436 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AO-022/43455436 has 0 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 AO-022/43455436?
The CAS number of AO-022/43455436 is 836643-11-9.
What is the molecular formula of AO-022/43455436?
The molecular formula of AO-022/43455436 is C19H21BrN2O3S.
What is the molecular weight of AO-022/43455436?
The molecular weight of AO-022/43455436 is 436.05 g/mol.
Where can I buy AO-022/43455436?
You can request a quote for AO-022/43455436 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/43455436?
Yes, KEHONG BIO provides custom synthesis services for AO-022/43455436 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.