Acetamide, N-(4-(diethylamino)-5-oxo-1,3,6-cycloheptatrien-1-yl)-
TL;DR: Acetamide, N-(4-(diethylamino)-5-oxo-1,3,6-cycloheptatrien-1-yl)- (CAS 18188-70-0) is a chemical compound with molecular formula C13H18N2O2 and molecular weight 234.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(diethylamino)-5-oxocyclohepta-1,3,6-trien-1-yl]acetamide
Also Known As: (2-Diethylamino-5-acetamido)tropone, N-[4-(diethylamino)-5-oxocyclohepta-1,3,6-trien-1-yl]acetamide, Acetamide, N-(4-(diethylamino)-5-oxo-1,3,6-cycloheptatrien-1-yl)-, N-(4-(Diethylamino)-5-oxo-1,3,6-cycloheptatrien-1-yl)acetamide, N-[4-(Diethylamino)-5-oxo-1,3,6-cycloheptanetrien-1-yl]acetamide
| Molecular Formula | C13H18N2O2 |
|---|---|
| Molecular Weight | 234.14 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 234.13683 |
| Heavy Atoms | 17 |
| Complexity | 402.0 |
Chemical Identifiers
| CAS Number | 18188-70-0 |
|---|---|
| SMILES | CCN(CC)C1=CC=C(C=CC1=O)NC(=O)C |
| InChIKey | GXAPLUKSBBLYHI-UHFFFAOYSA-N |
Product Overview
Acetamide, N-(4-(diethylamino)-5-oxo-1,3,6-cycloheptatrien-1-yl)- (CAS 18188-70-0), with molecular formula C13H18N2O2 and molecular weight 234.14 g/mol. IUPAC: N-[4-(diethylamino)-5-oxocyclohepta-1,3,6-trien-1-yl]acetamide.
Chemical Property Profile of Acetamide, N-(4-(diethylamino)-5-oxo-1,3,6-cycloheptatrien-1-yl)-
Property Insights of Acetamide, N-(4-(diethylamino)-5-oxo-1,3,6-cycloheptatrien-1-yl)-
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetamide, N-(4-(diethylamino)-5-oxo-1,3,6-cycloheptatrien-1-yl)-. With a topological polar surface area (TPSA) of 49.4 Ų, Acetamide, N-(4-(diethylamino)-5-oxo-1,3,6-cycloheptatrien-1-yl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetamide, N-(4-(diethylamino)-5-oxo-1,3,6-cycloheptatrien-1-yl)- has 1 hydrogen bond donor(s) and 3 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 Acetamide, N-(4-(diethylamino)-5-oxo-1,3,6-cycloheptatrien-1-yl)-?
The CAS number of Acetamide, N-(4-(diethylamino)-5-oxo-1,3,6-cycloheptatrien-1-yl)- is 18188-70-0.
What is the molecular formula of Acetamide, N-(4-(diethylamino)-5-oxo-1,3,6-cycloheptatrien-1-yl)-?
The molecular formula of Acetamide, N-(4-(diethylamino)-5-oxo-1,3,6-cycloheptatrien-1-yl)- is C13H18N2O2.
What is the molecular weight of Acetamide, N-(4-(diethylamino)-5-oxo-1,3,6-cycloheptatrien-1-yl)-?
The molecular weight of Acetamide, N-(4-(diethylamino)-5-oxo-1,3,6-cycloheptatrien-1-yl)- is 234.14 g/mol.
Where can I buy Acetamide, N-(4-(diethylamino)-5-oxo-1,3,6-cycloheptatrien-1-yl)-?
You can request a quote for Acetamide, N-(4-(diethylamino)-5-oxo-1,3,6-cycloheptatrien-1-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetamide, N-(4-(diethylamino)-5-oxo-1,3,6-cycloheptatrien-1-yl)-?
Yes, KEHONG BIO provides custom synthesis services for Acetamide, N-(4-(diethylamino)-5-oxo-1,3,6-cycloheptatrien-1-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.