Benzenecarboximidamide, N-(2-(diethylamino)ethyl)-4-(1-methylethoxy)-, 4,4'-methylenebis(3-hydroxy-2-naphthalenecarboxylate) (1:1)
TL;DR: Benzenecarboximidamide, N-(2-(diethylamino)ethyl)-4-(1-methylethoxy)-, 4,4'-methylenebis(3-hydroxy-2-naphthalenecarboxylate) (1:1) (CAS 125575-12-4) is a chemical compound with molecular formula C39H43N3O7 and molecular weight 665.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3-carboxy-2-hydroxynaphthalen-1-yl)methyl]-3-hydroxynaphthalene-2-carboxylic acid;N'-[2-(diethylamino)ethyl]-4-propan-2-yloxybenzenecarboximidamide
Also Known As: Benzenecarboximidamide, N-(2-(diethylamino)ethyl)-4-(1-methylethoxy)-, 4,4'-methylenebis(3-hydroxy-2-naphthalenecarboxylate) (1:1), 4,4'-Methylenebis(3-hydroxynaphthalene-2-carboxylic acid)--N'-[2-(diethylamino)ethyl]-4-[(propan-2-yl)oxy]benzene-1-carboximidamide (1/1), 4-[(3-carboxy-2-hydroxynaphthalen-1-yl)methyl]-3-hydroxynaphthalene-2-carboxylic acid; N'-(2-diethylaminoethyl)-4-propan-2-yloxybenzenecarboximidamide, RefChem:324496
| Molecular Formula | C39H43N3O7 |
|---|---|
| Molecular Weight | 665.31 g/mol |
| LogP | 6.9123 |
| Topological Polar Surface Area | 165.91 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 12 |
| Exact Mass | 665.3101 |
| Heavy Atoms | 49 |
| Complexity | 1865.1265 |
Chemical Identifiers
| CAS Number | 125575-12-4 |
|---|---|
| SMILES | CCN(CC)CCN=C(C1=CC=C(C=C1)OC(C)C)N.C1=CC=C2C(=C1)C=C(C(=C2CC3=C(C(=CC4=CC=CC=C43)C(=O)O)O)O)C(=O)O |
Product Overview
Benzenecarboximidamide, N-(2-(diethylamino)ethyl)-4-(1-methylethoxy)-, 4,4'-methylenebis(3-hydroxy-2-naphthalenecarboxylate) (1:1) (CAS 125575-12-4), with molecular formula C39H43N3O7 and molecular weight 665.31 g/mol. IUPAC: 4-[(3-carboxy-2-hydroxynaphthalen-1-yl)methyl]-3-hydroxynaphthalene-2-carboxylic acid;N'-[2-(diethylamino)ethyl]-4-propan-2-yloxybenzenecarboximidamide.
Chemical Property Profile of Benzenecarboximidamide, N-(2-(diethylamino)ethyl)-4-(1-methylethoxy)-, 4,4'-methylenebis(3-hydroxy-2-naphthalenecarboxylate) (1:1)
Property Insights of Benzenecarboximidamide, N-(2-(diethylamino)ethyl)-4-(1-methylethoxy)-, 4,4'-methylenebis(3-hydroxy-2-naphthalenecarboxylate) (1:1)
The XLogP value of 6.9123 indicates that Benzenecarboximidamide, N-(2-(diethylamino)ethyl)-4-(1-methylethoxy)-, 4,4'-methylenebis(3-hydroxy-2-naphthalenecarboxylate) (1:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 165.91 Ų indicates high polarity, suggesting Benzenecarboximidamide, N-(2-(diethylamino)ethyl)-4-(1-methylethoxy)-, 4,4'-methylenebis(3-hydroxy-2-naphthalenecarboxylate) (1:1) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Benzenecarboximidamide, N-(2-(diethylamino)ethyl)-4-(1-methylethoxy)-, 4,4'-methylenebis(3-hydroxy-2-naphthalenecarboxylate) (1:1) has 5 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzenecarboximidamide, N-(2-(diethylamino)ethyl)-4-(1-methylethoxy)-, 4,4'-methylenebis(3-hydroxy-2-naphthalenecarboxylate) (1:1)?
The CAS number of Benzenecarboximidamide, N-(2-(diethylamino)ethyl)-4-(1-methylethoxy)-, 4,4'-methylenebis(3-hydroxy-2-naphthalenecarboxylate) (1:1) is 125575-12-4.
What is the molecular formula of Benzenecarboximidamide, N-(2-(diethylamino)ethyl)-4-(1-methylethoxy)-, 4,4'-methylenebis(3-hydroxy-2-naphthalenecarboxylate) (1:1)?
The molecular formula of Benzenecarboximidamide, N-(2-(diethylamino)ethyl)-4-(1-methylethoxy)-, 4,4'-methylenebis(3-hydroxy-2-naphthalenecarboxylate) (1:1) is C39H43N3O7.
What is the molecular weight of Benzenecarboximidamide, N-(2-(diethylamino)ethyl)-4-(1-methylethoxy)-, 4,4'-methylenebis(3-hydroxy-2-naphthalenecarboxylate) (1:1)?
The molecular weight of Benzenecarboximidamide, N-(2-(diethylamino)ethyl)-4-(1-methylethoxy)-, 4,4'-methylenebis(3-hydroxy-2-naphthalenecarboxylate) (1:1) is 665.31 g/mol.
Where can I buy Benzenecarboximidamide, N-(2-(diethylamino)ethyl)-4-(1-methylethoxy)-, 4,4'-methylenebis(3-hydroxy-2-naphthalenecarboxylate) (1:1)?
You can request a quote for Benzenecarboximidamide, N-(2-(diethylamino)ethyl)-4-(1-methylethoxy)-, 4,4'-methylenebis(3-hydroxy-2-naphthalenecarboxylate) (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenecarboximidamide, N-(2-(diethylamino)ethyl)-4-(1-methylethoxy)-, 4,4'-methylenebis(3-hydroxy-2-naphthalenecarboxylate) (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Benzenecarboximidamide, N-(2-(diethylamino)ethyl)-4-(1-methylethoxy)-, 4,4'-methylenebis(3-hydroxy-2-naphthalenecarboxylate) (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.