2,2-dibromo-1-methyl-N'-[1-(4-nitrophenyl)ethylidene]cyclopropanecarbohydrazide
TL;DR: 2,2-dibromo-1-methyl-N'-[1-(4-nitrophenyl)ethylidene]cyclopropanecarbohydrazide (CAS 6131-96-0) is a chemical compound with molecular formula C13H13Br2N3O3 and molecular weight 416.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dibromo-1-methyl-N-[(E)-1-(4-nitrophenyl)ethylideneamino]cyclopropane-1-carboxamide
Also Known As: BIM-0031537.P001, 2,2-dibromo-1-methyl-N'-[1-(4-nitrophenyl)ethylidene]cyclopropanecarbohydrazide, 2,2-dibromo-1-methyl-N-[(E)-1-(4-nitrophenyl)ethylideneamino]cyclopropane-1-carboxamide, 2,2-dibromo-1-methyl-N'-[(1E)-1-(4-nitrophenyl)ethylidene]cyclopropanecarbohydrazide, N-[(1E)-2-(4-nitrophenyl)-1-azaprop-1-enyl](2,2-dibromo-1-methylcyclopropyl)ca rboxamide
| Molecular Formula | C13H13Br2N3O3 |
|---|---|
| Molecular Weight | 416.93 g/mol |
| LogP | 3.3311 |
| Topological Polar Surface Area | 84.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 416.93237 |
| Heavy Atoms | 21 |
| Complexity | 628.0536 |
Chemical Identifiers
| CAS Number | 6131-96-0 |
|---|---|
| SMILES | C/C(=N\NC(=O)C1(CC1(Br)Br)C)/C2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
2,2-dibromo-1-methyl-N'-[1-(4-nitrophenyl)ethylidene]cyclopropanecarbohydrazide (CAS 6131-96-0), with molecular formula C13H13Br2N3O3 and molecular weight 416.93 g/mol. IUPAC: 2,2-dibromo-1-methyl-N-[(E)-1-(4-nitrophenyl)ethylideneamino]cyclopropane-1-carboxamide.
Chemical Property Profile of 2,2-dibromo-1-methyl-N'-[1-(4-nitrophenyl)ethylidene]cyclopropanecarbohydrazide
Property Insights of 2,2-dibromo-1-methyl-N'-[1-(4-nitrophenyl)ethylidene]cyclopropanecarbohydrazide
The XLogP value of 3.3311 indicates that 2,2-dibromo-1-methyl-N'-[1-(4-nitrophenyl)ethylidene]cyclopropanecarbohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2-dibromo-1-methyl-N'-[1-(4-nitrophenyl)ethylidene]cyclopropanecarbohydrazide. Following Lipinski's Rule of Five, 2,2-dibromo-1-methyl-N'-[1-(4-nitrophenyl)ethylidene]cyclopropanecarbohydrazide has 1 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-dibromo-1-methyl-N'-[1-(4-nitrophenyl)ethylidene]cyclopropanecarbohydrazide?
The CAS number of 2,2-dibromo-1-methyl-N'-[1-(4-nitrophenyl)ethylidene]cyclopropanecarbohydrazide is 6131-96-0.
What is the molecular formula of 2,2-dibromo-1-methyl-N'-[1-(4-nitrophenyl)ethylidene]cyclopropanecarbohydrazide?
The molecular formula of 2,2-dibromo-1-methyl-N'-[1-(4-nitrophenyl)ethylidene]cyclopropanecarbohydrazide is C13H13Br2N3O3.
What is the molecular weight of 2,2-dibromo-1-methyl-N'-[1-(4-nitrophenyl)ethylidene]cyclopropanecarbohydrazide?
The molecular weight of 2,2-dibromo-1-methyl-N'-[1-(4-nitrophenyl)ethylidene]cyclopropanecarbohydrazide is 416.93 g/mol.
Where can I buy 2,2-dibromo-1-methyl-N'-[1-(4-nitrophenyl)ethylidene]cyclopropanecarbohydrazide?
You can request a quote for 2,2-dibromo-1-methyl-N'-[1-(4-nitrophenyl)ethylidene]cyclopropanecarbohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-dibromo-1-methyl-N'-[1-(4-nitrophenyl)ethylidene]cyclopropanecarbohydrazide?
Yes, KEHONG BIO provides custom synthesis services for 2,2-dibromo-1-methyl-N'-[1-(4-nitrophenyl)ethylidene]cyclopropanecarbohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.