(7-Amino-2,3-dihydro-1,4-benzodioxin-6-yl)(3-iodophenyl)methanone
TL;DR: (7-Amino-2,3-dihydro-1,4-benzodioxin-6-yl)(3-iodophenyl)methanone (CAS 890091-75-5) is a chemical compound with molecular formula C15H12INO3 and molecular weight 380.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6-amino-2,3-dihydro-1,4-benzodioxin-7-yl)-(3-iodophenyl)methanone
Also Known As: ZERO/004642, (7-amino-2,3-dihydro-1,4-benzodioxin-6-yl)(3-iodophenyl)methanone, (6-amino-2,3-dihydro-1,4-benzodioxin-7-yl)-(3-iodophenyl)methanone, 7-amino(2H,3H-benzo[e]1,4-dioxin-6-yl) 3-iodophenyl ketone, 7-(3-IODOBENZOYL)-2,3-DIHYDRO-1,4-BENZODIOXIN-6-AMINE
| Molecular Formula | C15H12INO3 |
|---|---|
| Molecular Weight | 380.99 g/mol |
| LogP | 2.8756 |
| Topological Polar Surface Area | 61.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 380.98618 |
| Heavy Atoms | 20 |
| Complexity | 684.814 |
Chemical Identifiers
| CAS Number | 890091-75-5 |
|---|---|
| SMILES | C1COC2=C(O1)C=C(C(=C2)N)C(=O)C3=CC(=CC=C3)I |
Product Overview
(7-Amino-2,3-dihydro-1,4-benzodioxin-6-yl)(3-iodophenyl)methanone (CAS 890091-75-5), with molecular formula C15H12INO3 and molecular weight 380.99 g/mol. IUPAC: (6-amino-2,3-dihydro-1,4-benzodioxin-7-yl)-(3-iodophenyl)methanone.
Chemical Property Profile of (7-Amino-2,3-dihydro-1,4-benzodioxin-6-yl)(3-iodophenyl)methanone
Property Insights of (7-Amino-2,3-dihydro-1,4-benzodioxin-6-yl)(3-iodophenyl)methanone
The XLogP value of 2.8756 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (7-Amino-2,3-dihydro-1,4-benzodioxin-6-yl)(3-iodophenyl)methanone. The TPSA of 61.55 Ų falls within the moderate polarity range, balancing permeability and solubility for (7-Amino-2,3-dihydro-1,4-benzodioxin-6-yl)(3-iodophenyl)methanone. Following Lipinski's Rule of Five, (7-Amino-2,3-dihydro-1,4-benzodioxin-6-yl)(3-iodophenyl)methanone has 1 hydrogen bond donor(s) and 4 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 (7-Amino-2,3-dihydro-1,4-benzodioxin-6-yl)(3-iodophenyl)methanone?
The CAS number of (7-Amino-2,3-dihydro-1,4-benzodioxin-6-yl)(3-iodophenyl)methanone is 890091-75-5.
What is the molecular formula of (7-Amino-2,3-dihydro-1,4-benzodioxin-6-yl)(3-iodophenyl)methanone?
The molecular formula of (7-Amino-2,3-dihydro-1,4-benzodioxin-6-yl)(3-iodophenyl)methanone is C15H12INO3.
What is the molecular weight of (7-Amino-2,3-dihydro-1,4-benzodioxin-6-yl)(3-iodophenyl)methanone?
The molecular weight of (7-Amino-2,3-dihydro-1,4-benzodioxin-6-yl)(3-iodophenyl)methanone is 380.99 g/mol.
Where can I buy (7-Amino-2,3-dihydro-1,4-benzodioxin-6-yl)(3-iodophenyl)methanone?
You can request a quote for (7-Amino-2,3-dihydro-1,4-benzodioxin-6-yl)(3-iodophenyl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (7-Amino-2,3-dihydro-1,4-benzodioxin-6-yl)(3-iodophenyl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (7-Amino-2,3-dihydro-1,4-benzodioxin-6-yl)(3-iodophenyl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.