N,N-bis(2-cyanoethyl)-5-nitrothiophene-2-carboxamide
TL;DR: N,N-bis(2-cyanoethyl)-5-nitrothiophene-2-carboxamide (CAS 330836-75-4) is a chemical compound with molecular formula C11H10N4O3S and molecular weight 278.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-bis(2-cyanoethyl)-5-nitrothiophene-2-carboxamide
Also Known As: N,N-bis(2-cyanoethyl)-5-nitrothiophene-2-carboxamide, N,N-di2-cyanoethyl-5-nitro-2-thenamide, F0214-0257
| Molecular Formula | C11H10N4O3S |
|---|---|
| Molecular Weight | 278.05 g/mol |
| LogP | 1.92586 |
| Topological Polar Surface Area | 111.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 278.04736 |
| Heavy Atoms | 19 |
| Complexity | 537.0219 |
Chemical Identifiers
| CAS Number | 330836-75-4 |
|---|---|
| SMILES | C1=C(SC(=C1)[N+](=O)[O-])C(=O)N(CCC#N)CCC#N |
Product Overview
N,N-bis(2-cyanoethyl)-5-nitrothiophene-2-carboxamide (CAS 330836-75-4), with molecular formula C11H10N4O3S and molecular weight 278.05 g/mol. IUPAC: N,N-bis(2-cyanoethyl)-5-nitrothiophene-2-carboxamide.
Chemical Property Profile of N,N-bis(2-cyanoethyl)-5-nitrothiophene-2-carboxamide
Property Insights of N,N-bis(2-cyanoethyl)-5-nitrothiophene-2-carboxamide
The XLogP value of 1.92586 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-bis(2-cyanoethyl)-5-nitrothiophene-2-carboxamide. The TPSA of 111.03 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N-bis(2-cyanoethyl)-5-nitrothiophene-2-carboxamide. Following Lipinski's Rule of Five, N,N-bis(2-cyanoethyl)-5-nitrothiophene-2-carboxamide has 0 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,N-bis(2-cyanoethyl)-5-nitrothiophene-2-carboxamide?
The CAS number of N,N-bis(2-cyanoethyl)-5-nitrothiophene-2-carboxamide is 330836-75-4.
What is the molecular formula of N,N-bis(2-cyanoethyl)-5-nitrothiophene-2-carboxamide?
The molecular formula of N,N-bis(2-cyanoethyl)-5-nitrothiophene-2-carboxamide is C11H10N4O3S.
What is the molecular weight of N,N-bis(2-cyanoethyl)-5-nitrothiophene-2-carboxamide?
The molecular weight of N,N-bis(2-cyanoethyl)-5-nitrothiophene-2-carboxamide is 278.05 g/mol.
Where can I buy N,N-bis(2-cyanoethyl)-5-nitrothiophene-2-carboxamide?
You can request a quote for N,N-bis(2-cyanoethyl)-5-nitrothiophene-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-bis(2-cyanoethyl)-5-nitrothiophene-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N,N-bis(2-cyanoethyl)-5-nitrothiophene-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.