N-[2-methyl-5-phenyl-3-(thiomorpholinomethyl)pyrrol-1-yl]pyridine-4-carboxamide
TL;DR: N-[2-methyl-5-phenyl-3-(thiomorpholinomethyl)pyrrol-1-yl]pyridine-4-carboxamide (CAS 676266-40-3) is a chemical compound with molecular formula C22H24N4OS and molecular weight 392.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-methyl-5-phenyl-3-(thiomorpholin-4-ylmethyl)pyrrol-1-yl]pyridine-4-carboxamide
Also Known As: N-[2-methyl-5-phenyl-3-(1,4-thiazaperhydroin-4-ylmethyl)pyrrolyl]-4-pyridyl-carboxamide, N-[2-methyl-5-phenyl-3-(thiomorpholin-4-ylmethyl)pyrrol-1-yl]pyridine-4-carboxamide, N-[2-Methyl-5-phenyl-3-(thiomorpholin-4-ylmethyl)pyrrolyl]-4-pyridyl carboxamide, N-[2-methyl-5-phenyl-3-(thiomorpholinomethyl)pyrrol-1-yl]pyridine-4-carboxamide
| Molecular Formula | C22H24N4OS |
|---|---|
| Molecular Weight | 392.17 g/mol |
| LogP | 3.79122 |
| Topological Polar Surface Area | 50.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 392.16708 |
| Heavy Atoms | 28 |
| Complexity | 933.9304 |
Chemical Identifiers
| CAS Number | 676266-40-3 |
|---|---|
| SMILES | CC1=C(C=C(N1NC(=O)C2=CC=NC=C2)C3=CC=CC=C3)CN4CCSCC4 |
Product Overview
N-[2-methyl-5-phenyl-3-(thiomorpholinomethyl)pyrrol-1-yl]pyridine-4-carboxamide (CAS 676266-40-3), with molecular formula C22H24N4OS and molecular weight 392.17 g/mol. IUPAC: N-[2-methyl-5-phenyl-3-(thiomorpholin-4-ylmethyl)pyrrol-1-yl]pyridine-4-carboxamide.
Chemical Property Profile of N-[2-methyl-5-phenyl-3-(thiomorpholinomethyl)pyrrol-1-yl]pyridine-4-carboxamide
Property Insights of N-[2-methyl-5-phenyl-3-(thiomorpholinomethyl)pyrrol-1-yl]pyridine-4-carboxamide
The XLogP value of 3.79122 indicates that N-[2-methyl-5-phenyl-3-(thiomorpholinomethyl)pyrrol-1-yl]pyridine-4-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.16 Ų, N-[2-methyl-5-phenyl-3-(thiomorpholinomethyl)pyrrol-1-yl]pyridine-4-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[2-methyl-5-phenyl-3-(thiomorpholinomethyl)pyrrol-1-yl]pyridine-4-carboxamide has 1 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 N-[2-methyl-5-phenyl-3-(thiomorpholinomethyl)pyrrol-1-yl]pyridine-4-carboxamide?
The CAS number of N-[2-methyl-5-phenyl-3-(thiomorpholinomethyl)pyrrol-1-yl]pyridine-4-carboxamide is 676266-40-3.
What is the molecular formula of N-[2-methyl-5-phenyl-3-(thiomorpholinomethyl)pyrrol-1-yl]pyridine-4-carboxamide?
The molecular formula of N-[2-methyl-5-phenyl-3-(thiomorpholinomethyl)pyrrol-1-yl]pyridine-4-carboxamide is C22H24N4OS.
What is the molecular weight of N-[2-methyl-5-phenyl-3-(thiomorpholinomethyl)pyrrol-1-yl]pyridine-4-carboxamide?
The molecular weight of N-[2-methyl-5-phenyl-3-(thiomorpholinomethyl)pyrrol-1-yl]pyridine-4-carboxamide is 392.17 g/mol.
Where can I buy N-[2-methyl-5-phenyl-3-(thiomorpholinomethyl)pyrrol-1-yl]pyridine-4-carboxamide?
You can request a quote for N-[2-methyl-5-phenyl-3-(thiomorpholinomethyl)pyrrol-1-yl]pyridine-4-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[2-methyl-5-phenyl-3-(thiomorpholinomethyl)pyrrol-1-yl]pyridine-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[2-methyl-5-phenyl-3-(thiomorpholinomethyl)pyrrol-1-yl]pyridine-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.