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4-benzoyl-N-[3-(dimethylamino)propyl]-1H-pyrrole-2-carboxamide
TL;DR: 4-benzoyl-N-[3-(dimethylamino)propyl]-1H-pyrrole-2-carboxamide (CAS 477889-30-8) is a chemical compound with molecular formula C17H21N3O2 and molecular weight 299.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-benzoyl-N-[3-(dimethylamino)propyl]-1H-pyrrole-2-carboxamide
Also Known As: 4-benzoyl-N-[3-(dimethylamino)propyl]-1H-pyrrole-2-carboxamide, 4-benzoyl-N-(3-dimethylaminopropyl)-1H-pyrrole-2-carboxamide
| Molecular Formula | C17H21N3O2 |
|---|---|
| Molecular Weight | 299.16 g/mol |
| LogP | 1.9272 |
| Topological Polar Surface Area | 65.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 299.1634 |
| Heavy Atoms | 22 |
| Complexity | 632.3634 |
Chemical Identifiers
| CAS Number | 477889-30-8 |
|---|---|
| SMILES | CN(C)CCCNC(=O)C1=CC(=CN1)C(=O)C2=CC=CC=C2 |
Product Overview
4-benzoyl-N-[3-(dimethylamino)propyl]-1H-pyrrole-2-carboxamide (CAS 477889-30-8), with molecular formula C17H21N3O2 and molecular weight 299.16 g/mol. IUPAC: 4-benzoyl-N-[3-(dimethylamino)propyl]-1H-pyrrole-2-carboxamide.
Chemical Property Profile of 4-benzoyl-N-[3-(dimethylamino)propyl]-1H-pyrrole-2-carboxamide
Property Insights of 4-benzoyl-N-[3-(dimethylamino)propyl]-1H-pyrrole-2-carboxamide
The XLogP value of 1.9272 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-benzoyl-N-[3-(dimethylamino)propyl]-1H-pyrrole-2-carboxamide. The TPSA of 65.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-benzoyl-N-[3-(dimethylamino)propyl]-1H-pyrrole-2-carboxamide. Following Lipinski's Rule of Five, 4-benzoyl-N-[3-(dimethylamino)propyl]-1H-pyrrole-2-carboxamide has 2 hydrogen bond donor(s) and 3 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 4-benzoyl-N-[3-(dimethylamino)propyl]-1H-pyrrole-2-carboxamide?
The CAS number of 4-benzoyl-N-[3-(dimethylamino)propyl]-1H-pyrrole-2-carboxamide is 477889-30-8.
What is the molecular formula of 4-benzoyl-N-[3-(dimethylamino)propyl]-1H-pyrrole-2-carboxamide?
The molecular formula of 4-benzoyl-N-[3-(dimethylamino)propyl]-1H-pyrrole-2-carboxamide is C17H21N3O2.
What is the molecular weight of 4-benzoyl-N-[3-(dimethylamino)propyl]-1H-pyrrole-2-carboxamide?
The molecular weight of 4-benzoyl-N-[3-(dimethylamino)propyl]-1H-pyrrole-2-carboxamide is 299.16 g/mol.
Where can I buy 4-benzoyl-N-[3-(dimethylamino)propyl]-1H-pyrrole-2-carboxamide?
You can request a quote for 4-benzoyl-N-[3-(dimethylamino)propyl]-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 4-benzoyl-N-[3-(dimethylamino)propyl]-1H-pyrrole-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 4-benzoyl-N-[3-(dimethylamino)propyl]-1H-pyrrole-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.