N-(1,3-benzodioxol-5-ylmethylideneamino)pyridine-4-carboxamide
TL;DR: N-(1,3-benzodioxol-5-ylmethylideneamino)pyridine-4-carboxamide (CAS 735-97-7) is a chemical compound with molecular formula C14H11N3O3 and molecular weight 269.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-ylmethylideneamino)pyridine-4-carboxamide
Also Known As: N-(1,3-benzodioxol-5-ylmethylideneamino)pyridine-4-carboxamide, N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]pyridine-4-carbo, 4-Pyridinecarboxylicacid, 2-(1,3-benzodioxol-5-ylmethylene)hydrazide
| Molecular Formula | C14H11N3O3 |
|---|---|
| Molecular Weight | 269.08 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 72.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 269.08005 |
| Heavy Atoms | 20 |
| Complexity | 369.0 |
Chemical Identifiers
| CAS Number | 735-97-7 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)C=NNC(=O)C3=CC=NC=C3 |
| InChIKey | QWWUORAVCMVHAQ-UHFFFAOYSA-N |
Product Overview
N-(1,3-benzodioxol-5-ylmethylideneamino)pyridine-4-carboxamide (CAS 735-97-7), with molecular formula C14H11N3O3 and molecular weight 269.08 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethylideneamino)pyridine-4-carboxamide.
Chemical Property Profile of N-(1,3-benzodioxol-5-ylmethylideneamino)pyridine-4-carboxamide
Property Insights of N-(1,3-benzodioxol-5-ylmethylideneamino)pyridine-4-carboxamide
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,3-benzodioxol-5-ylmethylideneamino)pyridine-4-carboxamide. The TPSA of 72.8 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,3-benzodioxol-5-ylmethylideneamino)pyridine-4-carboxamide. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-ylmethylideneamino)pyridine-4-carboxamide has 1 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 N-(1,3-benzodioxol-5-ylmethylideneamino)pyridine-4-carboxamide?
The CAS number of N-(1,3-benzodioxol-5-ylmethylideneamino)pyridine-4-carboxamide is 735-97-7.
What is the molecular formula of N-(1,3-benzodioxol-5-ylmethylideneamino)pyridine-4-carboxamide?
The molecular formula of N-(1,3-benzodioxol-5-ylmethylideneamino)pyridine-4-carboxamide is C14H11N3O3.
What is the molecular weight of N-(1,3-benzodioxol-5-ylmethylideneamino)pyridine-4-carboxamide?
The molecular weight of N-(1,3-benzodioxol-5-ylmethylideneamino)pyridine-4-carboxamide is 269.08 g/mol.
Where can I buy N-(1,3-benzodioxol-5-ylmethylideneamino)pyridine-4-carboxamide?
You can request a quote for N-(1,3-benzodioxol-5-ylmethylideneamino)pyridine-4-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,3-benzodioxol-5-ylmethylideneamino)pyridine-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzodioxol-5-ylmethylideneamino)pyridine-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.