Methyl 2-({5-nitro-2-thienyl}methylene)hydrazinecarboxylate
TL;DR: Methyl 2-({5-nitro-2-thienyl}methylene)hydrazinecarboxylate (CAS 102741-36-6) is a chemical compound with molecular formula C7H7N3O4S and molecular weight 229.01573 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl N-[(E)-(5-nitrothiophen-2-yl)methylideneamino]carbamate
Also Known As: methyl 2-({5-nitro-2-thienyl}methylene)hydrazinecarboxylate, AN-329/40613881, 2-ethyl-4-hydroxy-5-methyl-benzoic acid ethyl ester, methyl N-[(E)-(5-nitrothiophen-2-yl)methylideneamino]carbamate, N-[(1E)-2-(5-nitro(2-thienyl))-1-azavinyl]methoxycarboxamide
Technical Specifications
| Molecular Formula | C7H7N3O4S |
| Molecular Weight | 229.01573 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 125.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 229.01573 Da |
| Heavy Atoms | 15 |
| Complexity | 278.0 |
| SMILES | COC(=O)N/N=C/C1=CC=C(S1)[N+](=O)[O-] |
| InChIKey | WYBICGSVBZRQKS-XBXARRHUSA-N |
Chemical Property Profile of Methyl 2-({5-nitro-2-thienyl}methylene)hydrazinecarboxylate
Property Insights of Methyl 2-({5-nitro-2-thienyl}methylene)hydrazinecarboxylate
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-({5-nitro-2-thienyl}methylene)hydrazinecarboxylate. The TPSA of 125.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-({5-nitro-2-thienyl}methylene)hydrazinecarboxylate. Following Lipinski's Rule of Five, Methyl 2-({5-nitro-2-thienyl}methylene)hydrazinecarboxylate 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
What is the CAS number of Methyl 2-({5-nitro-2-thienyl}methylene)hydrazinecarboxylate?
The CAS number of Methyl 2-({5-nitro-2-thienyl}methylene)hydrazinecarboxylate is 102741-36-6.
What is the molecular formula of Methyl 2-({5-nitro-2-thienyl}methylene)hydrazinecarboxylate?
The molecular formula of Methyl 2-({5-nitro-2-thienyl}methylene)hydrazinecarboxylate is C7H7N3O4S.
What is the molecular weight of Methyl 2-({5-nitro-2-thienyl}methylene)hydrazinecarboxylate?
The molecular weight of Methyl 2-({5-nitro-2-thienyl}methylene)hydrazinecarboxylate is 229.01573 g/mol.
Where can I buy Methyl 2-({5-nitro-2-thienyl}methylene)hydrazinecarboxylate?
You can request a quote for Methyl 2-({5-nitro-2-thienyl}methylene)hydrazinecarboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 2-({5-nitro-2-thienyl}methylene)hydrazinecarboxylate?
Yes, CoreyChem provides custom synthesis services for Methyl 2-({5-nitro-2-thienyl}methylene)hydrazinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.