Acetamide, N-tert-butyl-N-(1-cyano-2-(3-pyridyl)amidino)-, hydrate
TL;DR: Acetamide, N-tert-butyl-N-(1-cyano-2-(3-pyridyl)amidino)-, hydrate (CAS 73681-13-7) is a chemical compound with molecular formula C13H19N5O2 and molecular weight 277.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-tert-butyl-N-(N-cyano-N'-pyridin-3-ylcarbamimidoyl)acetamide;hydrate
Also Known As: Acetamide, N-tert-butyl-N-(1-cyano-2-(3-pyridyl)amidino)-, hydrate, N-tert-Butyl-N-(1-cyano-2-(3-pyridyl)amidino)acetamide hydrate, Acetamide,N-tert-butyl-N-(1-cyano-2- -,hydrate, ACETAMIDE,N-TERT-BUTYL-N-(1-CYANO-2-(PYRIDIN-3-YL)AMIDINO)-,HYDRATE, N-tert-butyl-N-(N-cyano-N'-pyridin-3-ylcarbamimidoyl)acetamide hydrate
| Molecular Formula | C13H19N5O2 |
|---|---|
| Molecular Weight | 277.15 g/mol |
| LogP | 0.96208 |
| Topological Polar Surface Area | 112.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 277.15387 |
| Heavy Atoms | 20 |
| Complexity | 513.80334 |
Chemical Identifiers
| CAS Number | 73681-13-7 |
|---|---|
| SMILES | CC(=O)N(C(=NC1=CN=CC=C1)NC#N)C(C)(C)C.O |
Product Overview
Acetamide, N-tert-butyl-N-(1-cyano-2-(3-pyridyl)amidino)-, hydrate (CAS 73681-13-7), with molecular formula C13H19N5O2 and molecular weight 277.15 g/mol. IUPAC: N-tert-butyl-N-(N-cyano-N'-pyridin-3-ylcarbamimidoyl)acetamide;hydrate.
Chemical Property Profile of Acetamide, N-tert-butyl-N-(1-cyano-2-(3-pyridyl)amidino)-, hydrate
Property Insights of Acetamide, N-tert-butyl-N-(1-cyano-2-(3-pyridyl)amidino)-, hydrate
The XLogP value of 0.96208 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetamide, N-tert-butyl-N-(1-cyano-2-(3-pyridyl)amidino)-, hydrate. The TPSA of 112.88 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetamide, N-tert-butyl-N-(1-cyano-2-(3-pyridyl)amidino)-, hydrate. Following Lipinski's Rule of Five, Acetamide, N-tert-butyl-N-(1-cyano-2-(3-pyridyl)amidino)-, hydrate has 1 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 Acetamide, N-tert-butyl-N-(1-cyano-2-(3-pyridyl)amidino)-, hydrate?
The CAS number of Acetamide, N-tert-butyl-N-(1-cyano-2-(3-pyridyl)amidino)-, hydrate is 73681-13-7.
What is the molecular formula of Acetamide, N-tert-butyl-N-(1-cyano-2-(3-pyridyl)amidino)-, hydrate?
The molecular formula of Acetamide, N-tert-butyl-N-(1-cyano-2-(3-pyridyl)amidino)-, hydrate is C13H19N5O2.
What is the molecular weight of Acetamide, N-tert-butyl-N-(1-cyano-2-(3-pyridyl)amidino)-, hydrate?
The molecular weight of Acetamide, N-tert-butyl-N-(1-cyano-2-(3-pyridyl)amidino)-, hydrate is 277.15 g/mol.
Where can I buy Acetamide, N-tert-butyl-N-(1-cyano-2-(3-pyridyl)amidino)-, hydrate?
You can request a quote for Acetamide, N-tert-butyl-N-(1-cyano-2-(3-pyridyl)amidino)-, hydrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetamide, N-tert-butyl-N-(1-cyano-2-(3-pyridyl)amidino)-, hydrate?
Yes, KEHONG BIO provides custom synthesis services for Acetamide, N-tert-butyl-N-(1-cyano-2-(3-pyridyl)amidino)-, hydrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.