3-chloro-N-(2,5-dimethyl-1H-pyrrol-1-yl)benzamide
TL;DR: 3-chloro-N-(2,5-dimethyl-1H-pyrrol-1-yl)benzamide (CAS 694466-75-6) is a chemical compound with molecular formula C13H13ClN2O and molecular weight 248.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-(2,5-dimethylpyrrol-1-yl)benzamide
Also Known As: 3-chloro-N-(2,5-dimethylpyrrol-1-yl)benzamide, 3-chloro-N-(2,5-dimethyl-1H-pyrrol-1-yl)benzamide, AH-487/42193764
| Molecular Formula | C13H13ClN2O |
|---|---|
| Molecular Weight | 248.07 g/mol |
| LogP | 3.14224 |
| Topological Polar Surface Area | 34.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 248.07164 |
| Heavy Atoms | 17 |
| Complexity | 540.7971 |
Chemical Identifiers
| CAS Number | 694466-75-6 |
|---|---|
| SMILES | CC1=CC=C(N1NC(=O)C2=CC(=CC=C2)Cl)C |
Product Overview
3-chloro-N-(2,5-dimethyl-1H-pyrrol-1-yl)benzamide (CAS 694466-75-6), with molecular formula C13H13ClN2O and molecular weight 248.07 g/mol. IUPAC: 3-chloro-N-(2,5-dimethylpyrrol-1-yl)benzamide.
Chemical Property Profile of 3-chloro-N-(2,5-dimethyl-1H-pyrrol-1-yl)benzamide
Property Insights of 3-chloro-N-(2,5-dimethyl-1H-pyrrol-1-yl)benzamide
The XLogP value of 3.14224 indicates that 3-chloro-N-(2,5-dimethyl-1H-pyrrol-1-yl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.03 Ų, 3-chloro-N-(2,5-dimethyl-1H-pyrrol-1-yl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-chloro-N-(2,5-dimethyl-1H-pyrrol-1-yl)benzamide has 1 hydrogen bond donor(s) and 1 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 3-chloro-N-(2,5-dimethyl-1H-pyrrol-1-yl)benzamide?
The CAS number of 3-chloro-N-(2,5-dimethyl-1H-pyrrol-1-yl)benzamide is 694466-75-6.
What is the molecular formula of 3-chloro-N-(2,5-dimethyl-1H-pyrrol-1-yl)benzamide?
The molecular formula of 3-chloro-N-(2,5-dimethyl-1H-pyrrol-1-yl)benzamide is C13H13ClN2O.
What is the molecular weight of 3-chloro-N-(2,5-dimethyl-1H-pyrrol-1-yl)benzamide?
The molecular weight of 3-chloro-N-(2,5-dimethyl-1H-pyrrol-1-yl)benzamide is 248.07 g/mol.
Where can I buy 3-chloro-N-(2,5-dimethyl-1H-pyrrol-1-yl)benzamide?
You can request a quote for 3-chloro-N-(2,5-dimethyl-1H-pyrrol-1-yl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-chloro-N-(2,5-dimethyl-1H-pyrrol-1-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-chloro-N-(2,5-dimethyl-1H-pyrrol-1-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.