N'-(3,3-dimethyl-3,4-dihydro-1-isoquinolinyl)nicotinohydrazide
TL;DR: N'-(3,3-dimethyl-3,4-dihydro-1-isoquinolinyl)nicotinohydrazide (CAS 332413-29-3) is a chemical compound with molecular formula C17H18N4O and molecular weight 294.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-(3,3-dimethyl-4H-isoquinolin-1-yl)pyridine-3-carbohydrazide
Also Known As: BAS 00470498, Nicotinic acid N'-(3,3-dimethyl-3,4-dihydro-isoquinolin-1-yl)-hydrazide, N'-(3,3-dimethyl-3,4-dihydro-1-isoquinolinyl)nicotinohydrazide, N'-(3,3-dimethyl-3,4-dihydroisoquinolin-1-yl)nicotinohydrazide, N'-(3,3-dimethyl-4H-isoquinolin-1-yl)pyridine-3-carbohydrazide
| Molecular Formula | C17H18N4O |
|---|---|
| Molecular Weight | 294.15 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 294.14807 |
| Heavy Atoms | 22 |
| Complexity | 446.0 |
Chemical Identifiers
| CAS Number | 332413-29-3 |
|---|---|
| SMILES | CC1(CC2=CC=CC=C2C(=N1)NNC(=O)C3=CN=CC=C3)C |
| InChIKey | HWMPEXNQLRDKOT-UHFFFAOYSA-N |
Product Overview
N'-(3,3-dimethyl-3,4-dihydro-1-isoquinolinyl)nicotinohydrazide (CAS 332413-29-3), with molecular formula C17H18N4O and molecular weight 294.15 g/mol. IUPAC: N'-(3,3-dimethyl-4H-isoquinolin-1-yl)pyridine-3-carbohydrazide.
Chemical Property Profile of N'-(3,3-dimethyl-3,4-dihydro-1-isoquinolinyl)nicotinohydrazide
Property Insights of N'-(3,3-dimethyl-3,4-dihydro-1-isoquinolinyl)nicotinohydrazide
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N'-(3,3-dimethyl-3,4-dihydro-1-isoquinolinyl)nicotinohydrazide. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N'-(3,3-dimethyl-3,4-dihydro-1-isoquinolinyl)nicotinohydrazide. Following Lipinski's Rule of Five, N'-(3,3-dimethyl-3,4-dihydro-1-isoquinolinyl)nicotinohydrazide has 2 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 N'-(3,3-dimethyl-3,4-dihydro-1-isoquinolinyl)nicotinohydrazide?
The CAS number of N'-(3,3-dimethyl-3,4-dihydro-1-isoquinolinyl)nicotinohydrazide is 332413-29-3.
What is the molecular formula of N'-(3,3-dimethyl-3,4-dihydro-1-isoquinolinyl)nicotinohydrazide?
The molecular formula of N'-(3,3-dimethyl-3,4-dihydro-1-isoquinolinyl)nicotinohydrazide is C17H18N4O.
What is the molecular weight of N'-(3,3-dimethyl-3,4-dihydro-1-isoquinolinyl)nicotinohydrazide?
The molecular weight of N'-(3,3-dimethyl-3,4-dihydro-1-isoquinolinyl)nicotinohydrazide is 294.15 g/mol.
Where can I buy N'-(3,3-dimethyl-3,4-dihydro-1-isoquinolinyl)nicotinohydrazide?
You can request a quote for N'-(3,3-dimethyl-3,4-dihydro-1-isoquinolinyl)nicotinohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N'-(3,3-dimethyl-3,4-dihydro-1-isoquinolinyl)nicotinohydrazide?
Yes, KEHONG BIO provides custom synthesis services for N'-(3,3-dimethyl-3,4-dihydro-1-isoquinolinyl)nicotinohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.