1H-Imidazole-5-carboxamide, N-(4-(bis(2-chloroethyl)amino)phenyl)-1,2-dimethyl-4-nitro-
TL;DR: 1H-Imidazole-5-carboxamide, N-(4-(bis(2-chloroethyl)amino)phenyl)-1,2-dimethyl-4-nitro- (CAS 61982-02-3) is a chemical compound with molecular formula C16H19Cl2N5O3 and molecular weight 399.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[bis(2-chloroethyl)amino]phenyl]-2,3-dimethyl-5-nitroimidazole-4-carboxamide
Also Known As: 1H-Imidazole-5-carboxamide, N-(4-(bis(2-chloroethyl)amino)phenyl)-1,2-dimethyl-4-nitro-, N-(4-(Bis(2-chloroethyl)amino)phenyl)-1,2-dimethyl-4-nitro-1H-imidazole-5-carboxamide, N-[4-[bis(2-chloroethyl)amino]phenyl]-2,3-dimethyl-5-nitroimidazole-4-carboxamide, N-{4-[Bis(2-chloroethyl)amino]phenyl}-1,2-dimethyl-4-nitro-1H-imidazole-5-carboxamide, BRN 0715939
| Molecular Formula | C16H19Cl2N5O3 |
|---|---|
| Molecular Weight | 399.09 g/mol |
| LogP | 3.17302 |
| Topological Polar Surface Area | 93.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 399.0865 |
| Heavy Atoms | 26 |
| Complexity | 785.92804 |
Chemical Identifiers
| CAS Number | 61982-02-3 |
|---|---|
| SMILES | CC1=NC(=C(N1C)C(=O)NC2=CC=C(C=C2)N(CCCl)CCCl)[N+](=O)[O-] |
Product Overview
1H-Imidazole-5-carboxamide, N-(4-(bis(2-chloroethyl)amino)phenyl)-1,2-dimethyl-4-nitro- (CAS 61982-02-3), with molecular formula C16H19Cl2N5O3 and molecular weight 399.09 g/mol. IUPAC: N-[4-[bis(2-chloroethyl)amino]phenyl]-2,3-dimethyl-5-nitroimidazole-4-carboxamide.
Chemical Property Profile of 1H-Imidazole-5-carboxamide, N-(4-(bis(2-chloroethyl)amino)phenyl)-1,2-dimethyl-4-nitro-
Property Insights of 1H-Imidazole-5-carboxamide, N-(4-(bis(2-chloroethyl)amino)phenyl)-1,2-dimethyl-4-nitro-
The XLogP value of 3.17302 indicates that 1H-Imidazole-5-carboxamide, N-(4-(bis(2-chloroethyl)amino)phenyl)-1,2-dimethyl-4-nitro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Imidazole-5-carboxamide, N-(4-(bis(2-chloroethyl)amino)phenyl)-1,2-dimethyl-4-nitro-. Following Lipinski's Rule of Five, 1H-Imidazole-5-carboxamide, N-(4-(bis(2-chloroethyl)amino)phenyl)-1,2-dimethyl-4-nitro- has 1 hydrogen bond donor(s) and 5 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 1H-Imidazole-5-carboxamide, N-(4-(bis(2-chloroethyl)amino)phenyl)-1,2-dimethyl-4-nitro-?
The CAS number of 1H-Imidazole-5-carboxamide, N-(4-(bis(2-chloroethyl)amino)phenyl)-1,2-dimethyl-4-nitro- is 61982-02-3.
What is the molecular formula of 1H-Imidazole-5-carboxamide, N-(4-(bis(2-chloroethyl)amino)phenyl)-1,2-dimethyl-4-nitro-?
The molecular formula of 1H-Imidazole-5-carboxamide, N-(4-(bis(2-chloroethyl)amino)phenyl)-1,2-dimethyl-4-nitro- is C16H19Cl2N5O3.
What is the molecular weight of 1H-Imidazole-5-carboxamide, N-(4-(bis(2-chloroethyl)amino)phenyl)-1,2-dimethyl-4-nitro-?
The molecular weight of 1H-Imidazole-5-carboxamide, N-(4-(bis(2-chloroethyl)amino)phenyl)-1,2-dimethyl-4-nitro- is 399.09 g/mol.
Where can I buy 1H-Imidazole-5-carboxamide, N-(4-(bis(2-chloroethyl)amino)phenyl)-1,2-dimethyl-4-nitro-?
You can request a quote for 1H-Imidazole-5-carboxamide, N-(4-(bis(2-chloroethyl)amino)phenyl)-1,2-dimethyl-4-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Imidazole-5-carboxamide, N-(4-(bis(2-chloroethyl)amino)phenyl)-1,2-dimethyl-4-nitro-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Imidazole-5-carboxamide, N-(4-(bis(2-chloroethyl)amino)phenyl)-1,2-dimethyl-4-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.