3-Imino-3-morpholin-4-yl-2-(p-tolyl-hydrazono)-propionitrile
TL;DR: 3-Imino-3-morpholin-4-yl-2-(p-tolyl-hydrazono)-propionitrile (CAS 136272-72-5) is a chemical compound with molecular formula C14H17N5O and molecular weight 271.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1E)-2-imino-N-(4-methylanilino)-2-morpholin-4-ylethanimidoyl cyanide
Also Known As: 3-Imino-3-morpholin-4-yl-2-(p-tolyl-hydrazono)-propionitrile, 3-imino-3-morpholino-2-(p-tolylhydrazono)propionitrile, A2999/0126328, (E)-2-imino-2-morpholino-N'-(p-tolyl)acetohydrazonoyl cyanide, 2-imino-N-(4-methylanilino)-2-morpholin-4-ylethanimidoyl cyanide
| Molecular Formula | C14H17N5O |
|---|---|
| Molecular Weight | 271.14 g/mol |
| LogP | 1.59597 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 271.1433 |
| Heavy Atoms | 20 |
| Complexity | 537.67786 |
Chemical Identifiers
| CAS Number | 136272-72-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N/N=C(\C#N)/C(=N)N2CCOCC2 |
Product Overview
3-Imino-3-morpholin-4-yl-2-(p-tolyl-hydrazono)-propionitrile (CAS 136272-72-5), with molecular formula C14H17N5O and molecular weight 271.14 g/mol. IUPAC: (1E)-2-imino-N-(4-methylanilino)-2-morpholin-4-ylethanimidoyl cyanide.
Chemical Property Profile of 3-Imino-3-morpholin-4-yl-2-(p-tolyl-hydrazono)-propionitrile
Property Insights of 3-Imino-3-morpholin-4-yl-2-(p-tolyl-hydrazono)-propionitrile
The XLogP value of 1.59597 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Imino-3-morpholin-4-yl-2-(p-tolyl-hydrazono)-propionitrile. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Imino-3-morpholin-4-yl-2-(p-tolyl-hydrazono)-propionitrile. Following Lipinski's Rule of Five, 3-Imino-3-morpholin-4-yl-2-(p-tolyl-hydrazono)-propionitrile has 2 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 3-Imino-3-morpholin-4-yl-2-(p-tolyl-hydrazono)-propionitrile?
The CAS number of 3-Imino-3-morpholin-4-yl-2-(p-tolyl-hydrazono)-propionitrile is 136272-72-5.
What is the molecular formula of 3-Imino-3-morpholin-4-yl-2-(p-tolyl-hydrazono)-propionitrile?
The molecular formula of 3-Imino-3-morpholin-4-yl-2-(p-tolyl-hydrazono)-propionitrile is C14H17N5O.
What is the molecular weight of 3-Imino-3-morpholin-4-yl-2-(p-tolyl-hydrazono)-propionitrile?
The molecular weight of 3-Imino-3-morpholin-4-yl-2-(p-tolyl-hydrazono)-propionitrile is 271.14 g/mol.
Where can I buy 3-Imino-3-morpholin-4-yl-2-(p-tolyl-hydrazono)-propionitrile?
You can request a quote for 3-Imino-3-morpholin-4-yl-2-(p-tolyl-hydrazono)-propionitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Imino-3-morpholin-4-yl-2-(p-tolyl-hydrazono)-propionitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-Imino-3-morpholin-4-yl-2-(p-tolyl-hydrazono)-propionitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.