1-benzyl-2,3-dimethyl-N-(3-nitrophenyl)indole-5-carboxamide
TL;DR: 1-benzyl-2,3-dimethyl-N-(3-nitrophenyl)indole-5-carboxamide (CAS 514854-83-2) is a chemical compound with molecular formula C24H21N3O3 and molecular weight 399.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-2,3-dimethyl-N-(3-nitrophenyl)indole-5-carboxamide
Also Known As: 1-benzyl-2,3-dimethyl-N-(3-nitrophenyl)indole-5-carboxamide, 1-benzyl-2,3-dimethyl-N-(3-nitrophenyl)-1H-indole-5-carboxamide, 1-benzyl-N-{3-nitrophenyl}-2,3-dimethyl-1H-indole-5-carboxamide
| Molecular Formula | C24H21N3O3 |
|---|---|
| Molecular Weight | 399.16 g/mol |
| LogP | 5.46694 |
| Topological Polar Surface Area | 77.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 399.1583 |
| Heavy Atoms | 30 |
| Complexity | 1259.6777 |
Chemical Identifiers
| CAS Number | 514854-83-2 |
|---|---|
| SMILES | CC1=C(N(C2=C1C=C(C=C2)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-])CC4=CC=CC=C4)C |
Product Overview
1-benzyl-2,3-dimethyl-N-(3-nitrophenyl)indole-5-carboxamide (CAS 514854-83-2), with molecular formula C24H21N3O3 and molecular weight 399.16 g/mol. IUPAC: 1-benzyl-2,3-dimethyl-N-(3-nitrophenyl)indole-5-carboxamide.
Chemical Property Profile of 1-benzyl-2,3-dimethyl-N-(3-nitrophenyl)indole-5-carboxamide
Property Insights of 1-benzyl-2,3-dimethyl-N-(3-nitrophenyl)indole-5-carboxamide
The XLogP value of 5.46694 indicates that 1-benzyl-2,3-dimethyl-N-(3-nitrophenyl)indole-5-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.17 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-benzyl-2,3-dimethyl-N-(3-nitrophenyl)indole-5-carboxamide. Following Lipinski's Rule of Five, 1-benzyl-2,3-dimethyl-N-(3-nitrophenyl)indole-5-carboxamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-benzyl-2,3-dimethyl-N-(3-nitrophenyl)indole-5-carboxamide?
The CAS number of 1-benzyl-2,3-dimethyl-N-(3-nitrophenyl)indole-5-carboxamide is 514854-83-2.
What is the molecular formula of 1-benzyl-2,3-dimethyl-N-(3-nitrophenyl)indole-5-carboxamide?
The molecular formula of 1-benzyl-2,3-dimethyl-N-(3-nitrophenyl)indole-5-carboxamide is C24H21N3O3.
What is the molecular weight of 1-benzyl-2,3-dimethyl-N-(3-nitrophenyl)indole-5-carboxamide?
The molecular weight of 1-benzyl-2,3-dimethyl-N-(3-nitrophenyl)indole-5-carboxamide is 399.16 g/mol.
Where can I buy 1-benzyl-2,3-dimethyl-N-(3-nitrophenyl)indole-5-carboxamide?
You can request a quote for 1-benzyl-2,3-dimethyl-N-(3-nitrophenyl)indole-5-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-benzyl-2,3-dimethyl-N-(3-nitrophenyl)indole-5-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 1-benzyl-2,3-dimethyl-N-(3-nitrophenyl)indole-5-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.