![N-[1-(2-Chloroethyl)-4,5-dihydro-1H-imidazol-2-yl]nitramide structure](/static/products/6339/6339-06-6.webp)
N-[1-(2-Chloroethyl)-4,5-dihydro-1H-imidazol-2-yl]nitramide
TL;DR: N-[1-(2-Chloroethyl)-4,5-dihydro-1H-imidazol-2-yl]nitramide (CAS 6339-06-6) is a chemical compound with molecular formula C5H9ClN4O2 and molecular weight 192.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[1-(2-chloroethyl)-4,5-dihydroimidazol-2-yl]nitramide
Also Known As: 2,5-Dimethyl-benzenesulfonic acid, N-[1-(2-chloroethyl)-4,5-dihydroimidazol-2-yl]nitramide, N-[1-(2-Chloroethyl)-4,5-dihydro-1H-imidazol-2-yl]nitramide
| Molecular Formula | C5H9ClN4O2 |
|---|---|
| Molecular Weight | 192.04 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 73.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 192.0414 |
| Heavy Atoms | 12 |
| Complexity | 202.0 |
Chemical Identifiers
| CAS Number | 6339-06-6 |
|---|---|
| SMILES | C1CN(C(=N1)N[N+](=O)[O-])CCCl |
| InChIKey | UZVSHCNZHUESBZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-[1-(2-Chloroethyl)-4,5-dihydro-1H-imidazol-2-yl]nitramide (CAS 6339-06-6), with molecular formula C5H9ClN4O2 and molecular weight 192.04 g/mol. IUPAC: N-[1-(2-chloroethyl)-4,5-dihydroimidazol-2-yl]nitramide.
Chemical Property Profile of N-[1-(2-Chloroethyl)-4,5-dihydro-1H-imidazol-2-yl]nitramide
Property Insights of N-[1-(2-Chloroethyl)-4,5-dihydro-1H-imidazol-2-yl]nitramide
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[1-(2-Chloroethyl)-4,5-dihydro-1H-imidazol-2-yl]nitramide. The TPSA of 73.5 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[1-(2-Chloroethyl)-4,5-dihydro-1H-imidazol-2-yl]nitramide. Following Lipinski's Rule of Five, N-[1-(2-Chloroethyl)-4,5-dihydro-1H-imidazol-2-yl]nitramide has 1 hydrogen bond donor(s) and 3 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-[1-(2-Chloroethyl)-4,5-dihydro-1H-imidazol-2-yl]nitramide?
The CAS number of N-[1-(2-Chloroethyl)-4,5-dihydro-1H-imidazol-2-yl]nitramide is 6339-06-6.
What is the molecular formula of N-[1-(2-Chloroethyl)-4,5-dihydro-1H-imidazol-2-yl]nitramide?
The molecular formula of N-[1-(2-Chloroethyl)-4,5-dihydro-1H-imidazol-2-yl]nitramide is C5H9ClN4O2.
What is the molecular weight of N-[1-(2-Chloroethyl)-4,5-dihydro-1H-imidazol-2-yl]nitramide?
The molecular weight of N-[1-(2-Chloroethyl)-4,5-dihydro-1H-imidazol-2-yl]nitramide is 192.04 g/mol.
Where can I buy N-[1-(2-Chloroethyl)-4,5-dihydro-1H-imidazol-2-yl]nitramide?
You can request a quote for N-[1-(2-Chloroethyl)-4,5-dihydro-1H-imidazol-2-yl]nitramide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[1-(2-Chloroethyl)-4,5-dihydro-1H-imidazol-2-yl]nitramide?
Yes, KEHONG BIO provides custom synthesis services for N-[1-(2-Chloroethyl)-4,5-dihydro-1H-imidazol-2-yl]nitramide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.