F0533-0280
TL;DR: F0533-0280 (CAS 393830-65-4) is a chemical compound with molecular formula C21H20N4O3S and molecular weight 408.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-methoxyphenyl)-1-(3-nitrophenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide
Also Known As: F0533-0280, N-(4-methoxyphenyl)-1-(3-nitrophenyl)-1H,2H,3H,4H-pyrrolo[1,2-a]pyrazine-2-carbothioamide, N-(4-methoxyphenyl)-1-(3-nitrophenyl)-3,4-dihydropyrrolo[1,2-a]pyrazine-2(1H)-carbothioamide, N-(4-methoxyphenyl)-1-(3-nitrophenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide
| Molecular Formula | C21H20N4O3S |
|---|---|
| Molecular Weight | 408.13 g/mol |
| LogP | 4.2069 |
| Topological Polar Surface Area | 72.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 408.1256 |
| Heavy Atoms | 29 |
| Complexity | 1048.0896 |
Chemical Identifiers
| CAS Number | 393830-65-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC(=S)N2CCN3C=CC=C3C2C4=CC(=CC=C4)[N+](=O)[O-] |
Product Overview
F0533-0280 (CAS 393830-65-4), with molecular formula C21H20N4O3S and molecular weight 408.13 g/mol. IUPAC: N-(4-methoxyphenyl)-1-(3-nitrophenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide.
Chemical Property Profile of F0533-0280
Property Insights of F0533-0280
The XLogP value of 4.2069 indicates that F0533-0280 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.57 Ų falls within the moderate polarity range, balancing permeability and solubility for F0533-0280. Following Lipinski's Rule of Five, F0533-0280 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 F0533-0280?
The CAS number of F0533-0280 is 393830-65-4.
What is the molecular formula of F0533-0280?
The molecular formula of F0533-0280 is C21H20N4O3S.
What is the molecular weight of F0533-0280?
The molecular weight of F0533-0280 is 408.13 g/mol.
Where can I buy F0533-0280?
You can request a quote for F0533-0280 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0533-0280?
Yes, KEHONG BIO provides custom synthesis services for F0533-0280 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.