N-{5-benzyl-4H,5H,6H,7H-[1,3]thiazolo[4,5-c]pyridin-2-yl}-3-(4-chlorophenyl)-2-cyanoprop-2-enamide
TL;DR: N-{5-benzyl-4H,5H,6H,7H-[1,3]thiazolo[4,5-c]pyridin-2-yl}-3-(4-chlorophenyl)-2-cyanoprop-2-enamide (CAS 716375-56-3) is a chemical compound with molecular formula C23H19ClN4OS and molecular weight 434.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-(5-benzyl-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-2-yl)-3-(4-chlorophenyl)-2-cyanoprop-2-enamide
Also Known As: N-{5-benzyl-4H,5H,6H,7H-[1,3]thiazolo[4,5-c]pyridin-2-yl}-3-(4-chlorophenyl)-2-cyanoprop-2-enamide, (E)-N-(5-benzyl-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-2-yl)-3-(4-chlorophenyl)-2-cyanoprop-2-enamide
| Molecular Formula | C23H19ClN4OS |
|---|---|
| Molecular Weight | 434.10 g/mol |
| LogP | 4.90048 |
| Topological Polar Surface Area | 69.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 434.0968 |
| Heavy Atoms | 30 |
| Complexity | 1116.3549 |
Chemical Identifiers
| CAS Number | 716375-56-3 |
|---|---|
| SMILES | C1CN(CC2=C1SC(=N2)NC(=O)/C(=C/C3=CC=C(C=C3)Cl)/C#N)CC4=CC=CC=C4 |
Product Overview
N-{5-benzyl-4H,5H,6H,7H-[1,3]thiazolo[4,5-c]pyridin-2-yl}-3-(4-chlorophenyl)-2-cyanoprop-2-enamide (CAS 716375-56-3), with molecular formula C23H19ClN4OS and molecular weight 434.10 g/mol. IUPAC: (E)-N-(5-benzyl-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-2-yl)-3-(4-chlorophenyl)-2-cyanoprop-2-enamide.
Chemical Property Profile of N-{5-benzyl-4H,5H,6H,7H-[1,3]thiazolo[4,5-c]pyridin-2-yl}-3-(4-chlorophenyl)-2-cyanoprop-2-enamide
Property Insights of N-{5-benzyl-4H,5H,6H,7H-[1,3]thiazolo[4,5-c]pyridin-2-yl}-3-(4-chlorophenyl)-2-cyanoprop-2-enamide
The XLogP value of 4.90048 indicates that N-{5-benzyl-4H,5H,6H,7H-[1,3]thiazolo[4,5-c]pyridin-2-yl}-3-(4-chlorophenyl)-2-cyanoprop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.02 Ų falls within the moderate polarity range, balancing permeability and solubility for N-{5-benzyl-4H,5H,6H,7H-[1,3]thiazolo[4,5-c]pyridin-2-yl}-3-(4-chlorophenyl)-2-cyanoprop-2-enamide. Following Lipinski's Rule of Five, N-{5-benzyl-4H,5H,6H,7H-[1,3]thiazolo[4,5-c]pyridin-2-yl}-3-(4-chlorophenyl)-2-cyanoprop-2-enamide has 1 hydrogen bond donor(s) and 5 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-benzyl-4H,5H,6H,7H-[1,3]thiazolo[4,5-c]pyridin-2-yl}-3-(4-chlorophenyl)-2-cyanoprop-2-enamide?
The CAS number of N-{5-benzyl-4H,5H,6H,7H-[1,3]thiazolo[4,5-c]pyridin-2-yl}-3-(4-chlorophenyl)-2-cyanoprop-2-enamide is 716375-56-3.
What is the molecular formula of N-{5-benzyl-4H,5H,6H,7H-[1,3]thiazolo[4,5-c]pyridin-2-yl}-3-(4-chlorophenyl)-2-cyanoprop-2-enamide?
The molecular formula of N-{5-benzyl-4H,5H,6H,7H-[1,3]thiazolo[4,5-c]pyridin-2-yl}-3-(4-chlorophenyl)-2-cyanoprop-2-enamide is C23H19ClN4OS.
What is the molecular weight of N-{5-benzyl-4H,5H,6H,7H-[1,3]thiazolo[4,5-c]pyridin-2-yl}-3-(4-chlorophenyl)-2-cyanoprop-2-enamide?
The molecular weight of N-{5-benzyl-4H,5H,6H,7H-[1,3]thiazolo[4,5-c]pyridin-2-yl}-3-(4-chlorophenyl)-2-cyanoprop-2-enamide is 434.10 g/mol.
Where can I buy N-{5-benzyl-4H,5H,6H,7H-[1,3]thiazolo[4,5-c]pyridin-2-yl}-3-(4-chlorophenyl)-2-cyanoprop-2-enamide?
You can request a quote for N-{5-benzyl-4H,5H,6H,7H-[1,3]thiazolo[4,5-c]pyridin-2-yl}-3-(4-chlorophenyl)-2-cyanoprop-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-{5-benzyl-4H,5H,6H,7H-[1,3]thiazolo[4,5-c]pyridin-2-yl}-3-(4-chlorophenyl)-2-cyanoprop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for N-{5-benzyl-4H,5H,6H,7H-[1,3]thiazolo[4,5-c]pyridin-2-yl}-3-(4-chlorophenyl)-2-cyanoprop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.