N-(1,3-benzodioxol-5-ylmethyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide
TL;DR: N-(1,3-benzodioxol-5-ylmethyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide (CAS 616210-80-1) is a chemical compound with molecular formula C17H15NO5 and molecular weight 313.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-ylmethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide
Also Known As: BAS 07589401, N-(1,3-benzodioxol-5-ylmethyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide, N-(1,3-benzodioxol-5-ylmethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide, 2,3-Dihydro-benzo[1,4]dioxine-2-carboxylic acid (benzo[1,3]dioxol-5-ylmethyl)-amide, N-(2H-1,3-benzodioxol-5-ylmethyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide
| Molecular Formula | C17H15NO5 |
|---|---|
| Molecular Weight | 313.10 g/mol |
| LogP | 1.8715 |
| Topological Polar Surface Area | 66.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 313.09503 |
| Heavy Atoms | 23 |
| Complexity | 745.5136 |
Chemical Identifiers
| CAS Number | 616210-80-1 |
|---|---|
| SMILES | C1C(OC2=CC=CC=C2O1)C(=O)NCC3=CC4=C(C=C3)OCO4 |
Product Overview
N-(1,3-benzodioxol-5-ylmethyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide (CAS 616210-80-1), with molecular formula C17H15NO5 and molecular weight 313.10 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide.
Chemical Property Profile of N-(1,3-benzodioxol-5-ylmethyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide
Property Insights of N-(1,3-benzodioxol-5-ylmethyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide
The XLogP value of 1.8715 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,3-benzodioxol-5-ylmethyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide. The TPSA of 66.02 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,3-benzodioxol-5-ylmethyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-ylmethyl)-2,3-dihydro-1,4-benzodioxine-2-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)-2,3-dihydro-1,4-benzodioxine-2-carboxamide?
The CAS number of N-(1,3-benzodioxol-5-ylmethyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide is 616210-80-1.
What is the molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide?
The molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide is C17H15NO5.
What is the molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide?
The molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide is 313.10 g/mol.
Where can I buy N-(1,3-benzodioxol-5-ylmethyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide?
You can request a quote for N-(1,3-benzodioxol-5-ylmethyl)-2,3-dihydro-1,4-benzodioxine-2-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)-2,3-dihydro-1,4-benzodioxine-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzodioxol-5-ylmethyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.