N-(5-benzylthiazol-2-yl)-1-oxoisochroman-3-carboxamide
TL;DR: N-(5-benzylthiazol-2-yl)-1-oxoisochroman-3-carboxamide (CAS 874466-92-9) is a chemical compound with molecular formula C20H16N2O3S and molecular weight 364.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-benzyl-1,3-thiazol-2-yl)-1-oxo-3,4-dihydroisochromene-3-carboxamide
Also Known As: VU0513245-1, N-(5-benzylthiazol-2-yl)-1-oxoisochroman-3-carboxamide, F3210-0056, N-(5-benzyl-1,3-thiazol-2-yl)-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide, N-(5-benzyl-1,3-thiazol-2-yl)-1-oxo-3,4-dihydroisochromene-3-carboxamide
| Molecular Formula | C20H16N2O3S |
|---|---|
| Molecular Weight | 364.09 g/mol |
| LogP | 3.4541 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 364.08817 |
| Heavy Atoms | 26 |
| Complexity | 952.45483 |
Chemical Identifiers
| CAS Number | 874466-92-9 |
|---|---|
| SMILES | C1C(OC(=O)C2=CC=CC=C21)C(=O)NC3=NC=C(S3)CC4=CC=CC=C4 |
Product Overview
N-(5-benzylthiazol-2-yl)-1-oxoisochroman-3-carboxamide (CAS 874466-92-9), with molecular formula C20H16N2O3S and molecular weight 364.09 g/mol. IUPAC: N-(5-benzyl-1,3-thiazol-2-yl)-1-oxo-3,4-dihydroisochromene-3-carboxamide.
Chemical Property Profile of N-(5-benzylthiazol-2-yl)-1-oxoisochroman-3-carboxamide
Property Insights of N-(5-benzylthiazol-2-yl)-1-oxoisochroman-3-carboxamide
The XLogP value of 3.4541 indicates that N-(5-benzylthiazol-2-yl)-1-oxoisochroman-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.29 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(5-benzylthiazol-2-yl)-1-oxoisochroman-3-carboxamide. Following Lipinski's Rule of Five, N-(5-benzylthiazol-2-yl)-1-oxoisochroman-3-carboxamide 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-benzylthiazol-2-yl)-1-oxoisochroman-3-carboxamide?
The CAS number of N-(5-benzylthiazol-2-yl)-1-oxoisochroman-3-carboxamide is 874466-92-9.
What is the molecular formula of N-(5-benzylthiazol-2-yl)-1-oxoisochroman-3-carboxamide?
The molecular formula of N-(5-benzylthiazol-2-yl)-1-oxoisochroman-3-carboxamide is C20H16N2O3S.
What is the molecular weight of N-(5-benzylthiazol-2-yl)-1-oxoisochroman-3-carboxamide?
The molecular weight of N-(5-benzylthiazol-2-yl)-1-oxoisochroman-3-carboxamide is 364.09 g/mol.
Where can I buy N-(5-benzylthiazol-2-yl)-1-oxoisochroman-3-carboxamide?
You can request a quote for N-(5-benzylthiazol-2-yl)-1-oxoisochroman-3-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-benzylthiazol-2-yl)-1-oxoisochroman-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(5-benzylthiazol-2-yl)-1-oxoisochroman-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.