N~3~-Formyl-N~3~-(5-nitro-1,3-thiazol-2-yl)-beta-alaninamide
TL;DR: N~3~-Formyl-N~3~-(5-nitro-1,3-thiazol-2-yl)-beta-alaninamide (CAS 50384-06-0) is a chemical compound with molecular formula C7H8N4O4S and molecular weight 244.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[formyl-(5-nitro-1,3-thiazol-2-yl)amino]propanamide
Also Known As: 1,2-divinylcyclohex-2-en-1-ol, 3-[formyl-(5-nitro-1,3-thiazol-2-yl)amino]propanamide, Propanamide, 3-[formyl(5-nitro-2-thiazolyl)amino]-, N~3~-Formyl-N~3~-(5-nitro-1,3-thiazol-2-yl)-beta-alaninamide
| Molecular Formula | C7H8N4O4S |
|---|---|
| Molecular Weight | 244.03 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 150.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 244.02663 |
| Heavy Atoms | 16 |
| Complexity | 295.0 |
Chemical Identifiers
| CAS Number | 50384-06-0 |
|---|---|
| SMILES | C1=C(SC(=N1)N(CCC(=O)N)C=O)[N+](=O)[O-] |
| InChIKey | WOWYCMINZHTTRO-UHFFFAOYSA-N |
Product Overview
N~3~-Formyl-N~3~-(5-nitro-1,3-thiazol-2-yl)-beta-alaninamide (CAS 50384-06-0), with molecular formula C7H8N4O4S and molecular weight 244.03 g/mol. IUPAC: 3-[formyl-(5-nitro-1,3-thiazol-2-yl)amino]propanamide.
Chemical Property Profile of N~3~-Formyl-N~3~-(5-nitro-1,3-thiazol-2-yl)-beta-alaninamide
Property Insights of N~3~-Formyl-N~3~-(5-nitro-1,3-thiazol-2-yl)-beta-alaninamide
The XLogP value of -0.3 indicates that N~3~-Formyl-N~3~-(5-nitro-1,3-thiazol-2-yl)-beta-alaninamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 150.0 Ų indicates high polarity, suggesting N~3~-Formyl-N~3~-(5-nitro-1,3-thiazol-2-yl)-beta-alaninamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N~3~-Formyl-N~3~-(5-nitro-1,3-thiazol-2-yl)-beta-alaninamide has 1 hydrogen bond donor(s) and 6 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 N~3~-Formyl-N~3~-(5-nitro-1,3-thiazol-2-yl)-beta-alaninamide?
The CAS number of N~3~-Formyl-N~3~-(5-nitro-1,3-thiazol-2-yl)-beta-alaninamide is 50384-06-0.
What is the molecular formula of N~3~-Formyl-N~3~-(5-nitro-1,3-thiazol-2-yl)-beta-alaninamide?
The molecular formula of N~3~-Formyl-N~3~-(5-nitro-1,3-thiazol-2-yl)-beta-alaninamide is C7H8N4O4S.
What is the molecular weight of N~3~-Formyl-N~3~-(5-nitro-1,3-thiazol-2-yl)-beta-alaninamide?
The molecular weight of N~3~-Formyl-N~3~-(5-nitro-1,3-thiazol-2-yl)-beta-alaninamide is 244.03 g/mol.
Where can I buy N~3~-Formyl-N~3~-(5-nitro-1,3-thiazol-2-yl)-beta-alaninamide?
You can request a quote for N~3~-Formyl-N~3~-(5-nitro-1,3-thiazol-2-yl)-beta-alaninamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N~3~-Formyl-N~3~-(5-nitro-1,3-thiazol-2-yl)-beta-alaninamide?
Yes, KEHONG BIO provides custom synthesis services for N~3~-Formyl-N~3~-(5-nitro-1,3-thiazol-2-yl)-beta-alaninamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.