F0533-0468
TL;DR: F0533-0468 (CAS 393832-66-1) is a chemical compound with molecular formula C21H22N4O2S and molecular weight 394.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,5-dimethoxyphenyl)-1-pyridin-4-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide
Also Known As: F0533-0468, N-(2,5-dimethoxyphenyl)-1-(pyridin-4-yl)-1H,2H,3H,4H-pyrrolo[1,2-a]pyrazine-2-carbothioamide, N-(2,5-dimethoxyphenyl)-1-(pyridin-4-yl)-3,4-dihydropyrrolo[1,2-a]pyrazine-2(1H)-carbothioamide, N-(2,5-dimethoxyphenyl)-1-pyridin-4-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide
| Molecular Formula | C21H22N4O2S |
|---|---|
| Molecular Weight | 394.15 g/mol |
| LogP | 3.7023 |
| Topological Polar Surface Area | 51.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 394.14636 |
| Heavy Atoms | 28 |
| Complexity | 973.54675 |
Chemical Identifiers
| CAS Number | 393832-66-1 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)OC)NC(=S)N2CCN3C=CC=C3C2C4=CC=NC=C4 |
Product Overview
F0533-0468 (CAS 393832-66-1), with molecular formula C21H22N4O2S and molecular weight 394.15 g/mol. IUPAC: N-(2,5-dimethoxyphenyl)-1-pyridin-4-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide.
Chemical Property Profile of F0533-0468
Property Insights of F0533-0468
The XLogP value of 3.7023 indicates that F0533-0468 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.55 Ų, F0533-0468 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F0533-0468 has 1 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 F0533-0468?
The CAS number of F0533-0468 is 393832-66-1.
What is the molecular formula of F0533-0468?
The molecular formula of F0533-0468 is C21H22N4O2S.
What is the molecular weight of F0533-0468?
The molecular weight of F0533-0468 is 394.15 g/mol.
Where can I buy F0533-0468?
You can request a quote for F0533-0468 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0533-0468?
Yes, KEHONG BIO provides custom synthesis services for F0533-0468 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.