N-(1,3-benzodioxol-5-ylmethyl)-2-oxochromene-3-carboxamide
TL;DR: N-(1,3-benzodioxol-5-ylmethyl)-2-oxochromene-3-carboxamide (CAS 325810-66-0) is a chemical compound with molecular formula C18H13NO5 and molecular weight 323.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-ylmethyl)-2-oxochromene-3-carboxamide
Also Known As: IFLab1_003785, IDI1_009892, BAS 01126193, N-(1,3-benzodioxol-5-ylmethyl)-2-oxochromene-3-carboxamide, N-(benzo[d][1,3]dioxol-5-ylmethyl)-2-oxo-2H-chromene-3-carboxamide
| Molecular Formula | C18H13NO5 |
|---|---|
| Molecular Weight | 323.08 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 73.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 323.07938 |
| Heavy Atoms | 24 |
| Complexity | 546.0 |
Chemical Identifiers
| CAS Number | 325810-66-0 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC4=CC=CC=C4OC3=O |
| InChIKey | CKYINRFRIDYIOV-UHFFFAOYSA-N |
Product Overview
N-(1,3-benzodioxol-5-ylmethyl)-2-oxochromene-3-carboxamide (CAS 325810-66-0), with molecular formula C18H13NO5 and molecular weight 323.08 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-2-oxochromene-3-carboxamide.
Chemical Property Profile of N-(1,3-benzodioxol-5-ylmethyl)-2-oxochromene-3-carboxamide
Property Insights of N-(1,3-benzodioxol-5-ylmethyl)-2-oxochromene-3-carboxamide
The XLogP value of 3.3 indicates that N-(1,3-benzodioxol-5-ylmethyl)-2-oxochromene-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,3-benzodioxol-5-ylmethyl)-2-oxochromene-3-carboxamide. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-ylmethyl)-2-oxochromene-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-(1,3-benzodioxol-5-ylmethyl)-2-oxochromene-3-carboxamide?
The CAS number of N-(1,3-benzodioxol-5-ylmethyl)-2-oxochromene-3-carboxamide is 325810-66-0.
What is the molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-2-oxochromene-3-carboxamide?
The molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-2-oxochromene-3-carboxamide is C18H13NO5.
What is the molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-2-oxochromene-3-carboxamide?
The molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-2-oxochromene-3-carboxamide is 323.08 g/mol.
Where can I buy N-(1,3-benzodioxol-5-ylmethyl)-2-oxochromene-3-carboxamide?
You can request a quote for N-(1,3-benzodioxol-5-ylmethyl)-2-oxochromene-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-(1,3-benzodioxol-5-ylmethyl)-2-oxochromene-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzodioxol-5-ylmethyl)-2-oxochromene-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.