Dibenzoyl 2-amino-6,7-dihydroxy-1,2,3,4-tetrahydronaphthalene
TL;DR: Dibenzoyl 2-amino-6,7-dihydroxy-1,2,3,4-tetrahydronaphthalene (CAS 70172-52-0) is a chemical compound with molecular formula C24H21NO4 and molecular weight 387.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6-amino-3-benzoyloxy-5,6,7,8-tetrahydronaphthalen-2-yl) benzoate
Also Known As: DB-6,7-Adtn, ADTN 5,6, (+-)-(1-Butoxy-butyl)-acetat, Dibenzoyl-2-amino-6,7-dihydroxytetralin, 6-amino-5,6,7,8-tetrahydronaphthalene-2,3-diyl dibenzoate
| Molecular Formula | C24H21NO4 |
|---|---|
| Molecular Weight | 387.15 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 78.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 387.14706 |
| Heavy Atoms | 29 |
| Complexity | 567.0 |
Chemical Identifiers
| CAS Number | 70172-52-0 |
|---|---|
| SMILES | C1CC2=CC(=C(C=C2CC1N)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4 |
| InChIKey | GSKLFVJWZBQVTK-UHFFFAOYSA-N |
Product Overview
Dibenzoyl 2-amino-6,7-dihydroxy-1,2,3,4-tetrahydronaphthalene (CAS 70172-52-0), with molecular formula C24H21NO4 and molecular weight 387.15 g/mol. IUPAC: (6-amino-3-benzoyloxy-5,6,7,8-tetrahydronaphthalen-2-yl) benzoate.
Chemical Property Profile of Dibenzoyl 2-amino-6,7-dihydroxy-1,2,3,4-tetrahydronaphthalene
Property Insights of Dibenzoyl 2-amino-6,7-dihydroxy-1,2,3,4-tetrahydronaphthalene
The XLogP value of 4.5 indicates that Dibenzoyl 2-amino-6,7-dihydroxy-1,2,3,4-tetrahydronaphthalene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Dibenzoyl 2-amino-6,7-dihydroxy-1,2,3,4-tetrahydronaphthalene. Following Lipinski's Rule of Five, Dibenzoyl 2-amino-6,7-dihydroxy-1,2,3,4-tetrahydronaphthalene 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 Dibenzoyl 2-amino-6,7-dihydroxy-1,2,3,4-tetrahydronaphthalene?
The CAS number of Dibenzoyl 2-amino-6,7-dihydroxy-1,2,3,4-tetrahydronaphthalene is 70172-52-0.
What is the molecular formula of Dibenzoyl 2-amino-6,7-dihydroxy-1,2,3,4-tetrahydronaphthalene?
The molecular formula of Dibenzoyl 2-amino-6,7-dihydroxy-1,2,3,4-tetrahydronaphthalene is C24H21NO4.
What is the molecular weight of Dibenzoyl 2-amino-6,7-dihydroxy-1,2,3,4-tetrahydronaphthalene?
The molecular weight of Dibenzoyl 2-amino-6,7-dihydroxy-1,2,3,4-tetrahydronaphthalene is 387.15 g/mol.
Where can I buy Dibenzoyl 2-amino-6,7-dihydroxy-1,2,3,4-tetrahydronaphthalene?
You can request a quote for Dibenzoyl 2-amino-6,7-dihydroxy-1,2,3,4-tetrahydronaphthalene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dibenzoyl 2-amino-6,7-dihydroxy-1,2,3,4-tetrahydronaphthalene?
Yes, KEHONG BIO provides custom synthesis services for Dibenzoyl 2-amino-6,7-dihydroxy-1,2,3,4-tetrahydronaphthalene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.