RefChem:315275
TL;DR: RefChem:315275 (CAS 15499-07-7) is a chemical compound with molecular formula C13H19N3O2 and molecular weight 249.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[2-(dimethylamino)ethylamino]-5-oxocyclohepta-1,3,6-trien-1-yl]acetamide
Also Known As: Acetamide, N-(4-((2-(dimethylamino)ethyl)amino)-5-oxo-1,3,6-cycloheptatrien-1-yl)-, 2-(BETA-DIMETHYLAMINOETHYLAMINO-5-ACETAMIDO)TROPONE, N-(4-((2-(Dimethylamino)ethyl)amino)-5-oxo-1,3,6-cycloheptatrien-1-yl)acetamide, N-[4-[2-(dimethylamino)ethylamino]-5-oxocyclohepta-1,3,6-trien-1-yl]acetamide, N-(4-{[2-(DIMETHYLAMINO)ETHYL]AMINO}-5-OXOCYCLOHEPTA-1,3,6-TRIEN-1-YL)ACETAMIDE
| Molecular Formula | C13H19N3O2 |
|---|---|
| Molecular Weight | 249.15 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 61.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 249.14772 |
| Heavy Atoms | 18 |
| Complexity | 420.0 |
Chemical Identifiers
| CAS Number | 15499-07-7 |
|---|---|
| SMILES | CC(=O)NC1=CC=C(C(=O)C=C1)NCCN(C)C |
| InChIKey | JSLJNUDVJHUZPB-UHFFFAOYSA-N |
Product Overview
RefChem:315275 (CAS 15499-07-7), with molecular formula C13H19N3O2 and molecular weight 249.15 g/mol. IUPAC: N-[4-[2-(dimethylamino)ethylamino]-5-oxocyclohepta-1,3,6-trien-1-yl]acetamide.
Chemical Property Profile of RefChem:315275
Property Insights of RefChem:315275
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:315275. The TPSA of 61.4 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:315275. Following Lipinski's Rule of Five, RefChem:315275 has 2 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 RefChem:315275?
The CAS number of RefChem:315275 is 15499-07-7.
What is the molecular formula of RefChem:315275?
The molecular formula of RefChem:315275 is C13H19N3O2.
What is the molecular weight of RefChem:315275?
The molecular weight of RefChem:315275 is 249.15 g/mol.
Where can I buy RefChem:315275?
You can request a quote for RefChem:315275 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:315275?
Yes, KEHONG BIO provides custom synthesis services for RefChem:315275 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.