1-Pyrrolidinecarbothioic acid, (5-nitrofurfurylidene)hydrazide
TL;DR: 1-Pyrrolidinecarbothioic acid, (5-nitrofurfurylidene)hydrazide (CAS 14052-77-8) is a chemical compound with molecular formula C10H12N4O3S and molecular weight 268.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-(5-nitrofuran-2-yl)methylideneamino]pyrrolidine-1-carbothioamide
Also Known As: 1-Pyrrolidinecarbothioic acid, (5-nitrofurfurylidene)hydrazide, 1-(5-Nitrofurfurylidene)-2-(1-pyrrolidinylcarbonothioyl)hydrazine, N-[(E)-(5-nitrofuran-2-yl)methylideneamino]pyrrolidine-1-carbothioamide, N-Pyrrolidinothiocarbonyl-N'-(5-nitro-furfuryliden)-hydrazin, N-[(E)-(5-nitro-2-furyl)methyleneamino]pyrrolidine-1-carbothioamide
| Molecular Formula | C10H12N4O3S |
|---|---|
| Molecular Weight | 268.06 g/mol |
| LogP | 1.492 |
| Topological Polar Surface Area | 83.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 268.06302 |
| Heavy Atoms | 18 |
| Complexity | 479.22226 |
Chemical Identifiers
| CAS Number | 14052-77-8 |
|---|---|
| SMILES | C1CCN(C1)C(=S)N/N=C/C2=CC=C(O2)[N+](=O)[O-] |
Product Overview
1-Pyrrolidinecarbothioic acid, (5-nitrofurfurylidene)hydrazide (CAS 14052-77-8), with molecular formula C10H12N4O3S and molecular weight 268.06 g/mol. IUPAC: N-[(E)-(5-nitrofuran-2-yl)methylideneamino]pyrrolidine-1-carbothioamide.
Chemical Property Profile of 1-Pyrrolidinecarbothioic acid, (5-nitrofurfurylidene)hydrazide
Property Insights of 1-Pyrrolidinecarbothioic acid, (5-nitrofurfurylidene)hydrazide
The XLogP value of 1.492 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Pyrrolidinecarbothioic acid, (5-nitrofurfurylidene)hydrazide. The TPSA of 83.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Pyrrolidinecarbothioic acid, (5-nitrofurfurylidene)hydrazide. Following Lipinski's Rule of Five, 1-Pyrrolidinecarbothioic acid, (5-nitrofurfurylidene)hydrazide has 1 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 1-Pyrrolidinecarbothioic acid, (5-nitrofurfurylidene)hydrazide?
The CAS number of 1-Pyrrolidinecarbothioic acid, (5-nitrofurfurylidene)hydrazide is 14052-77-8.
What is the molecular formula of 1-Pyrrolidinecarbothioic acid, (5-nitrofurfurylidene)hydrazide?
The molecular formula of 1-Pyrrolidinecarbothioic acid, (5-nitrofurfurylidene)hydrazide is C10H12N4O3S.
What is the molecular weight of 1-Pyrrolidinecarbothioic acid, (5-nitrofurfurylidene)hydrazide?
The molecular weight of 1-Pyrrolidinecarbothioic acid, (5-nitrofurfurylidene)hydrazide is 268.06 g/mol.
Where can I buy 1-Pyrrolidinecarbothioic acid, (5-nitrofurfurylidene)hydrazide?
You can request a quote for 1-Pyrrolidinecarbothioic acid, (5-nitrofurfurylidene)hydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Pyrrolidinecarbothioic acid, (5-nitrofurfurylidene)hydrazide?
Yes, KEHONG BIO provides custom synthesis services for 1-Pyrrolidinecarbothioic acid, (5-nitrofurfurylidene)hydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.