2-(2,3,3-Trichloro-1-nitroprop-2-en-1-ylidene)imidazolidine
TL;DR: 2-(2,3,3-Trichloro-1-nitroprop-2-en-1-ylidene)imidazolidine (CAS 70265-23-5) is a chemical compound with molecular formula C6H6Cl3N3O2 and molecular weight 256.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,3,3-trichloro-1-nitroprop-2-enylidene)imidazolidine
Also Known As: BAS 00457283, NCI60_022448, 2-(2,3,3-Trichloro-1-nitro-allylidene)-imidazolidine, 2-(2,3,3-trichloro-1-nitroprop-2-en-1-ylidene)imidazolidine, 2-(2,3,3-trichloro-1-nitroallylidene)imidazolidine
| Molecular Formula | C6H6Cl3N3O2 |
|---|---|
| Molecular Weight | 256.95 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 69.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 256.95255 |
| Heavy Atoms | 14 |
| Complexity | 309.0 |
Chemical Identifiers
| CAS Number | 70265-23-5 |
|---|---|
| SMILES | C1CNC(=C(C(=C(Cl)Cl)Cl)[N+](=O)[O-])N1 |
| InChIKey | AFZQRVIAXVGDLI-UHFFFAOYSA-N |
Product Overview
2-(2,3,3-Trichloro-1-nitroprop-2-en-1-ylidene)imidazolidine (CAS 70265-23-5), with molecular formula C6H6Cl3N3O2 and molecular weight 256.95 g/mol. IUPAC: 2-(2,3,3-trichloro-1-nitroprop-2-enylidene)imidazolidine.
Chemical Property Profile of 2-(2,3,3-Trichloro-1-nitroprop-2-en-1-ylidene)imidazolidine
Property Insights of 2-(2,3,3-Trichloro-1-nitroprop-2-en-1-ylidene)imidazolidine
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2,3,3-Trichloro-1-nitroprop-2-en-1-ylidene)imidazolidine. The TPSA of 69.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2,3,3-Trichloro-1-nitroprop-2-en-1-ylidene)imidazolidine. Following Lipinski's Rule of Five, 2-(2,3,3-Trichloro-1-nitroprop-2-en-1-ylidene)imidazolidine has 2 hydrogen bond donor(s) and 4 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 2-(2,3,3-Trichloro-1-nitroprop-2-en-1-ylidene)imidazolidine?
The CAS number of 2-(2,3,3-Trichloro-1-nitroprop-2-en-1-ylidene)imidazolidine is 70265-23-5.
What is the molecular formula of 2-(2,3,3-Trichloro-1-nitroprop-2-en-1-ylidene)imidazolidine?
The molecular formula of 2-(2,3,3-Trichloro-1-nitroprop-2-en-1-ylidene)imidazolidine is C6H6Cl3N3O2.
What is the molecular weight of 2-(2,3,3-Trichloro-1-nitroprop-2-en-1-ylidene)imidazolidine?
The molecular weight of 2-(2,3,3-Trichloro-1-nitroprop-2-en-1-ylidene)imidazolidine is 256.95 g/mol.
Where can I buy 2-(2,3,3-Trichloro-1-nitroprop-2-en-1-ylidene)imidazolidine?
You can request a quote for 2-(2,3,3-Trichloro-1-nitroprop-2-en-1-ylidene)imidazolidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2,3,3-Trichloro-1-nitroprop-2-en-1-ylidene)imidazolidine?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,3,3-Trichloro-1-nitroprop-2-en-1-ylidene)imidazolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.