N-tert-butyl-4-(2,4-dichlorobenzoyl)-1H-pyrrole-2-carboxamide
TL;DR: N-tert-butyl-4-(2,4-dichlorobenzoyl)-1H-pyrrole-2-carboxamide (CAS 338977-06-3) is a chemical compound with molecular formula C16H16Cl2N2O2 and molecular weight 338.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-tert-butyl-4-(2,4-dichlorobenzoyl)-1H-pyrrole-2-carboxamide
Also Known As: N-tert-butyl-4-(2,4-dichlorobenzoyl)-1H-pyrrole-2-carboxamide, 9E-027, N-(tert-butyl)-4-(2,4-dichlorobenzoyl)-1H-pyrrole-2-carboxamide, 4-(2,4-dichlorobenzoyl)-N-tert-butyl-1H-pyrrole-2-carboxamide
| Molecular Formula | C16H16Cl2N2O2 |
|---|---|
| Molecular Weight | 338.06 g/mol |
| LogP | 4.0808 |
| Topological Polar Surface Area | 61.96 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 338.05887 |
| Heavy Atoms | 22 |
| Complexity | 729.9873 |
Chemical Identifiers
| CAS Number | 338977-06-3 |
|---|---|
| SMILES | CC(C)(C)NC(=O)C1=CC(=CN1)C(=O)C2=C(C=C(C=C2)Cl)Cl |
Product Overview
N-tert-butyl-4-(2,4-dichlorobenzoyl)-1H-pyrrole-2-carboxamide (CAS 338977-06-3), with molecular formula C16H16Cl2N2O2 and molecular weight 338.06 g/mol. IUPAC: N-tert-butyl-4-(2,4-dichlorobenzoyl)-1H-pyrrole-2-carboxamide.
Chemical Property Profile of N-tert-butyl-4-(2,4-dichlorobenzoyl)-1H-pyrrole-2-carboxamide
Property Insights of N-tert-butyl-4-(2,4-dichlorobenzoyl)-1H-pyrrole-2-carboxamide
The XLogP value of 4.0808 indicates that N-tert-butyl-4-(2,4-dichlorobenzoyl)-1H-pyrrole-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.96 Ų falls within the moderate polarity range, balancing permeability and solubility for N-tert-butyl-4-(2,4-dichlorobenzoyl)-1H-pyrrole-2-carboxamide. Following Lipinski's Rule of Five, N-tert-butyl-4-(2,4-dichlorobenzoyl)-1H-pyrrole-2-carboxamide has 2 hydrogen bond donor(s) and 2 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 N-tert-butyl-4-(2,4-dichlorobenzoyl)-1H-pyrrole-2-carboxamide?
The CAS number of N-tert-butyl-4-(2,4-dichlorobenzoyl)-1H-pyrrole-2-carboxamide is 338977-06-3.
What is the molecular formula of N-tert-butyl-4-(2,4-dichlorobenzoyl)-1H-pyrrole-2-carboxamide?
The molecular formula of N-tert-butyl-4-(2,4-dichlorobenzoyl)-1H-pyrrole-2-carboxamide is C16H16Cl2N2O2.
What is the molecular weight of N-tert-butyl-4-(2,4-dichlorobenzoyl)-1H-pyrrole-2-carboxamide?
The molecular weight of N-tert-butyl-4-(2,4-dichlorobenzoyl)-1H-pyrrole-2-carboxamide is 338.06 g/mol.
Where can I buy N-tert-butyl-4-(2,4-dichlorobenzoyl)-1H-pyrrole-2-carboxamide?
You can request a quote for N-tert-butyl-4-(2,4-dichlorobenzoyl)-1H-pyrrole-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-tert-butyl-4-(2,4-dichlorobenzoyl)-1H-pyrrole-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-tert-butyl-4-(2,4-dichlorobenzoyl)-1H-pyrrole-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.