F0533-0451
TL;DR: F0533-0451 (CAS 393832-49-0) is a chemical compound with molecular formula C20H20N4S and molecular weight 348.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-methylphenyl)-1-pyridin-4-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide
Also Known As: F0533-0451, 1-(pyridin-4-yl)-N-(p-tolyl)-3,4-dihydropyrrolo[1,2-a]pyrazine-2(1H)-carbothioamide, N-(4-methylphenyl)-1-(pyridin-4-yl)-1H,2H,3H,4H-pyrrolo[1,2-a]pyrazine-2-carbothioamide, N-(4-methylphenyl)-1-pyridin-4-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide, p-tolyl-7-(4-pyridyl)-3a,6-diaza-4,5,6,7-tetrahydro-6-indenecarbothioamide
| Molecular Formula | C20H20N4S |
|---|---|
| Molecular Weight | 348.14 g/mol |
| LogP | 3.99352 |
| Topological Polar Surface Area | 33.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 348.14087 |
| Heavy Atoms | 25 |
| Complexity | 870.2265 |
Chemical Identifiers
| CAS Number | 393832-49-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=S)N2CCN3C=CC=C3C2C4=CC=NC=C4 |
Product Overview
F0533-0451 (CAS 393832-49-0), with molecular formula C20H20N4S and molecular weight 348.14 g/mol. IUPAC: N-(4-methylphenyl)-1-pyridin-4-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide.
Chemical Property Profile of F0533-0451
Property Insights of F0533-0451
The XLogP value of 3.99352 indicates that F0533-0451 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.09 Ų, F0533-0451 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F0533-0451 has 1 hydrogen bond donor(s) and 2 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 F0533-0451?
The CAS number of F0533-0451 is 393832-49-0.
What is the molecular formula of F0533-0451?
The molecular formula of F0533-0451 is C20H20N4S.
What is the molecular weight of F0533-0451?
The molecular weight of F0533-0451 is 348.14 g/mol.
Where can I buy F0533-0451?
You can request a quote for F0533-0451 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0533-0451?
Yes, KEHONG BIO provides custom synthesis services for F0533-0451 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.