N-(5-chloro-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)pyridine-4-carboxamide
TL;DR: N-(5-chloro-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)pyridine-4-carboxamide (CAS 22931-36-8) is a chemical compound with molecular formula C14H12ClN3O3 and molecular weight 305.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-chloro-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)pyridine-4-carboxamide
Also Known As: BAS 01506806, N-(5-chloro-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)pyridine-4-carboxamide, N-(5-chloro-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)pyridine-4-carboxamide, N-(5-Chloro-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-isoindol-2-yl)-isonicotinamide, N-(5-chloro-1,3-dioxo-3a,4,7,7a-tetrahydro-1H-isoindol-2(3H)-yl)isonicotinamide
| Molecular Formula | C14H12ClN3O3 |
|---|---|
| Molecular Weight | 305.06 g/mol |
| LogP | 1.2441 |
| Topological Polar Surface Area | 79.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 305.05673 |
| Heavy Atoms | 21 |
| Complexity | 644.12415 |
Chemical Identifiers
| CAS Number | 22931-36-8 |
|---|---|
| SMILES | C1C=C(CC2C1C(=O)N(C2=O)NC(=O)C3=CC=NC=C3)Cl |
Product Overview
N-(5-chloro-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)pyridine-4-carboxamide (CAS 22931-36-8), with molecular formula C14H12ClN3O3 and molecular weight 305.06 g/mol. IUPAC: N-(5-chloro-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)pyridine-4-carboxamide.
Chemical Property Profile of N-(5-chloro-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)pyridine-4-carboxamide
Property Insights of N-(5-chloro-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)pyridine-4-carboxamide
The XLogP value of 1.2441 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(5-chloro-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)pyridine-4-carboxamide. The TPSA of 79.37 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(5-chloro-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)pyridine-4-carboxamide. Following Lipinski's Rule of Five, N-(5-chloro-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-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-(5-chloro-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)pyridine-4-carboxamide?
The CAS number of N-(5-chloro-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)pyridine-4-carboxamide is 22931-36-8.
What is the molecular formula of N-(5-chloro-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)pyridine-4-carboxamide?
The molecular formula of N-(5-chloro-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)pyridine-4-carboxamide is C14H12ClN3O3.
What is the molecular weight of N-(5-chloro-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)pyridine-4-carboxamide?
The molecular weight of N-(5-chloro-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)pyridine-4-carboxamide is 305.06 g/mol.
Where can I buy N-(5-chloro-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)pyridine-4-carboxamide?
You can request a quote for N-(5-chloro-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-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-(5-chloro-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)pyridine-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(5-chloro-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)pyridine-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.