1H-Benzimidazole, 6-nitro-1-(1-pyrrolidinylmethyl)-
TL;DR: 1H-Benzimidazole, 6-nitro-1-(1-pyrrolidinylmethyl)- (CAS 103248-20-0) is a chemical compound with molecular formula C12H14N4O2 and molecular weight 246.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-nitro-1-(pyrrolidin-1-ylmethyl)benzimidazole
Also Known As: 1H-Benzimidazole, 6-nitro-1-(1-pyrrolidinylmethyl)-, 6-Nitro-1-(1-pyrrolidinylmethyl)-1H-benzimidazole, 6-nitro-1-(pyrrolidin-1-ylmethyl)benzimidazole, 1H-Benzimidazole,6-nitro-1-(1-pyrrolidinylmethyl)-, 6-NITRO-1-(PYRROLIDIN-1-YLMETHYL)BENZOIMIDAZOLE
| Molecular Formula | C12H14N4O2 |
|---|---|
| Molecular Weight | 246.11 g/mol |
| LogP | 1.9978 |
| Topological Polar Surface Area | 64.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 246.11168 |
| Heavy Atoms | 18 |
| Complexity | 586.77496 |
Chemical Identifiers
| CAS Number | 103248-20-0 |
|---|---|
| SMILES | C1CCN(C1)CN2C=NC3=C2C=C(C=C3)[N+](=O)[O-] |
Product Overview
1H-Benzimidazole, 6-nitro-1-(1-pyrrolidinylmethyl)- (CAS 103248-20-0), with molecular formula C12H14N4O2 and molecular weight 246.11 g/mol. IUPAC: 6-nitro-1-(pyrrolidin-1-ylmethyl)benzimidazole.
Chemical Property Profile of 1H-Benzimidazole, 6-nitro-1-(1-pyrrolidinylmethyl)-
Property Insights of 1H-Benzimidazole, 6-nitro-1-(1-pyrrolidinylmethyl)-
The XLogP value of 1.9978 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Benzimidazole, 6-nitro-1-(1-pyrrolidinylmethyl)-. The TPSA of 64.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Benzimidazole, 6-nitro-1-(1-pyrrolidinylmethyl)-. Following Lipinski's Rule of Five, 1H-Benzimidazole, 6-nitro-1-(1-pyrrolidinylmethyl)- has 0 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 1H-Benzimidazole, 6-nitro-1-(1-pyrrolidinylmethyl)-?
The CAS number of 1H-Benzimidazole, 6-nitro-1-(1-pyrrolidinylmethyl)- is 103248-20-0.
What is the molecular formula of 1H-Benzimidazole, 6-nitro-1-(1-pyrrolidinylmethyl)-?
The molecular formula of 1H-Benzimidazole, 6-nitro-1-(1-pyrrolidinylmethyl)- is C12H14N4O2.
What is the molecular weight of 1H-Benzimidazole, 6-nitro-1-(1-pyrrolidinylmethyl)-?
The molecular weight of 1H-Benzimidazole, 6-nitro-1-(1-pyrrolidinylmethyl)- is 246.11 g/mol.
Where can I buy 1H-Benzimidazole, 6-nitro-1-(1-pyrrolidinylmethyl)-?
You can request a quote for 1H-Benzimidazole, 6-nitro-1-(1-pyrrolidinylmethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Benzimidazole, 6-nitro-1-(1-pyrrolidinylmethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Benzimidazole, 6-nitro-1-(1-pyrrolidinylmethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.