![Dimethyl 5-[(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)amino]isophthalate structure](/static/products/3554/355412-55-4.webp)
Dimethyl 5-[(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)amino]isophthalate
TL;DR: Dimethyl 5-[(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)amino]isophthalate (CAS 355412-55-4) is a chemical compound with molecular formula C19H17NO7 and molecular weight 371.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 5-(2,3-dihydro-1,4-benzodioxine-6-carbonylamino)benzene-1,3-dicarboxylate
Also Known As: ChemDiv1_006572, BAS 02573007, BIM-0005964.P001, AB00104026-01, AP-970/14964344
| Molecular Formula | C19H17NO7 |
|---|---|
| Molecular Weight | 371.10 g/mol |
| LogP | 2.2833 |
| Topological Polar Surface Area | 100.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 371.1005 |
| Heavy Atoms | 27 |
| Complexity | 872.67633 |
Chemical Identifiers
| CAS Number | 355412-55-4 |
|---|---|
| SMILES | COC(=O)C1=CC(=CC(=C1)NC(=O)C2=CC3=C(C=C2)OCCO3)C(=O)OC |
Product Overview
Dimethyl 5-[(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)amino]isophthalate (CAS 355412-55-4), with molecular formula C19H17NO7 and molecular weight 371.10 g/mol. IUPAC: dimethyl 5-(2,3-dihydro-1,4-benzodioxine-6-carbonylamino)benzene-1,3-dicarboxylate.
Chemical Property Profile of Dimethyl 5-[(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)amino]isophthalate
Property Insights of Dimethyl 5-[(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)amino]isophthalate
The XLogP value of 2.2833 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl 5-[(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)amino]isophthalate. The TPSA of 100.16 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 5-[(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)amino]isophthalate. Following Lipinski's Rule of Five, Dimethyl 5-[(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)amino]isophthalate has 1 hydrogen bond donor(s) and 7 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 Dimethyl 5-[(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)amino]isophthalate?
The CAS number of Dimethyl 5-[(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)amino]isophthalate is 355412-55-4.
What is the molecular formula of Dimethyl 5-[(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)amino]isophthalate?
The molecular formula of Dimethyl 5-[(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)amino]isophthalate is C19H17NO7.
What is the molecular weight of Dimethyl 5-[(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)amino]isophthalate?
The molecular weight of Dimethyl 5-[(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)amino]isophthalate is 371.10 g/mol.
Where can I buy Dimethyl 5-[(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)amino]isophthalate?
You can request a quote for Dimethyl 5-[(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)amino]isophthalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 5-[(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)amino]isophthalate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 5-[(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)amino]isophthalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.