(2-(3-Diethylaminopropylamino)-5-acetamido)tropone citrate
TL;DR: (2-(3-Diethylaminopropylamino)-5-acetamido)tropone citrate (CAS 15499-16-8) is a chemical compound with molecular formula C22H33N3O9 and molecular weight 483.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[3-(diethylamino)propylamino]-5-oxocyclohepta-1,3,6-trien-1-yl]acetamide;2-hydroxypropane-1,2,3-tricarboxylic acid
Also Known As: (2-(3-Diethylaminopropylamino)-5-acetamido)tropone citrate, Acetamide, N-(4-((3-(diethylamino)propyl)amino)-5-oxo-1,3,6-cycloheptatrien-1-yl)-, citrate (1:1), N-(4-((3-(Diethylamino)propyl)amino)-5-oxo-1,3,6-cycloheptatrien-1-yl)acetamide citrate, 2-Hydroxypropane-1,2,3-tricarboxylic acid--N-(4-{[3-(diethylamino)propyl]amino}-5-oxocyclohepta-1,3,6-trien-1-yl)acetamide (1/1), N-[4-[3-(diethylamino)propylamino]-5-oxocyclohepta-1,3,6-trien-1-yl]acetamide; 2-hydroxypropane-1,2,3-tricarboxylic acid
| Molecular Formula | C22H33N3O9 |
|---|---|
| Molecular Weight | 483.22 g/mol |
| LogP | 0.9005 |
| Topological Polar Surface Area | 194.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 13 |
| Exact Mass | 483.22168 |
| Heavy Atoms | 34 |
| Complexity | 688.0 |
Chemical Identifiers
| CAS Number | 15499-16-8 |
|---|---|
| SMILES | CCN(CC)CCCNC1=CC=C(C=CC1=O)NC(=O)C.C(C(=O)O)C(CC(=O)O)(C(=O)O)O |
| InChIKey | TUMCDJKVTWEDSQ-UHFFFAOYSA-N |
Product Overview
(2-(3-Diethylaminopropylamino)-5-acetamido)tropone citrate (CAS 15499-16-8), with molecular formula C22H33N3O9 and molecular weight 483.22 g/mol. IUPAC: N-[4-[3-(diethylamino)propylamino]-5-oxocyclohepta-1,3,6-trien-1-yl]acetamide;2-hydroxypropane-1,2,3-tricarboxylic acid.
Chemical Property Profile of (2-(3-Diethylaminopropylamino)-5-acetamido)tropone citrate
Property Insights of (2-(3-Diethylaminopropylamino)-5-acetamido)tropone citrate
The XLogP value of 0.9005 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-(3-Diethylaminopropylamino)-5-acetamido)tropone citrate. The TPSA of 194.0 Ų indicates high polarity, suggesting (2-(3-Diethylaminopropylamino)-5-acetamido)tropone citrate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (2-(3-Diethylaminopropylamino)-5-acetamido)tropone citrate has 6 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (2-(3-Diethylaminopropylamino)-5-acetamido)tropone citrate?
The CAS number of (2-(3-Diethylaminopropylamino)-5-acetamido)tropone citrate is 15499-16-8.
What is the molecular formula of (2-(3-Diethylaminopropylamino)-5-acetamido)tropone citrate?
The molecular formula of (2-(3-Diethylaminopropylamino)-5-acetamido)tropone citrate is C22H33N3O9.
What is the molecular weight of (2-(3-Diethylaminopropylamino)-5-acetamido)tropone citrate?
The molecular weight of (2-(3-Diethylaminopropylamino)-5-acetamido)tropone citrate is 483.22 g/mol.
Where can I buy (2-(3-Diethylaminopropylamino)-5-acetamido)tropone citrate?
You can request a quote for (2-(3-Diethylaminopropylamino)-5-acetamido)tropone citrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-(3-Diethylaminopropylamino)-5-acetamido)tropone citrate?
Yes, KEHONG BIO provides custom synthesis services for (2-(3-Diethylaminopropylamino)-5-acetamido)tropone citrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.