RefChem:272098
TL;DR: RefChem:272098 (CAS 161771-89-7) is a chemical compound with molecular formula C18H21N3O4 and molecular weight 343.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1,3-benzodioxol-5-yl)-3-N,5-N,2,6-tetramethyl-1,4-dihydropyridine-3,5-dicarboxamide
Also Known As: 3,5-Pyridinedicarboxamide, 1,4-dihydro-4-(1,3-benzodioxol-5-yl)-N,N',2,6-tetramethyl-, 1,4-Dihydro-4-(1,3-benzodioxol-5-yl)-N,N',2,6-tetramethyl-3,5-pyridinedicarboxamide, 4-(1,3-benzodioxol-5-yl)-3-N,5-N,2,6-tetramethyl-1,4-dihydropyridine-3,5-dicarboxamide, N,N ,2,6-Tetramethyl-4-(1,3-benzodioxol-5-yl)-1,4-dihydropyridine-3,5-dicarboxamide, 4-(2H-1,3-Benzodioxol-5-yl)-N~3~,N~5~,2,6-tetramethyl-1,4-dihydropyridine-3,5-dicarboxamide
| Molecular Formula | C18H21N3O4 |
|---|---|
| Molecular Weight | 343.15 g/mol |
| LogP | 1.1421 |
| Topological Polar Surface Area | 88.69 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 343.1532 |
| Heavy Atoms | 25 |
| Complexity | 772.53925 |
Chemical Identifiers
| CAS Number | 161771-89-7 |
|---|---|
| SMILES | CC1=C(C(C(=C(N1)C)C(=O)NC)C2=CC3=C(C=C2)OCO3)C(=O)NC |
Product Overview
RefChem:272098 (CAS 161771-89-7), with molecular formula C18H21N3O4 and molecular weight 343.15 g/mol. IUPAC: 4-(1,3-benzodioxol-5-yl)-3-N,5-N,2,6-tetramethyl-1,4-dihydropyridine-3,5-dicarboxamide.
Chemical Property Profile of RefChem:272098
Property Insights of RefChem:272098
The XLogP value of 1.1421 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:272098. The TPSA of 88.69 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:272098. Following Lipinski's Rule of Five, RefChem:272098 has 3 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 RefChem:272098?
The CAS number of RefChem:272098 is 161771-89-7.
What is the molecular formula of RefChem:272098?
The molecular formula of RefChem:272098 is C18H21N3O4.
What is the molecular weight of RefChem:272098?
The molecular weight of RefChem:272098 is 343.15 g/mol.
Where can I buy RefChem:272098?
You can request a quote for RefChem:272098 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:272098?
Yes, KEHONG BIO provides custom synthesis services for RefChem:272098 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.