2-cyano-3-(dimethylamino)-N'-(phenylmethylidene)prop-2-enehydrazide
TL;DR: 2-cyano-3-(dimethylamino)-N'-(phenylmethylidene)prop-2-enehydrazide (CAS 338779-05-8) is a chemical compound with molecular formula C13H14N4O and molecular weight 242.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(benzylideneamino)-2-cyano-3-(dimethylamino)prop-2-enamide
Also Known As: 2-cyano-3-(dimethylamino)-N'-(phenylmethylene)acrylohydrazide, 2-cyano-3-(dimethylamino)-N'-(phenylmethylidene)prop-2-enehydrazide, N-(benzylideneamino)-2-cyano-3-(dimethylamino)prop-2-enamide, N-(benzylideneamino)-2-cyano-3-dimethylamino-prop-2-enamide
| Molecular Formula | C13H14N4O |
|---|---|
| Molecular Weight | 242.12 g/mol |
| LogP | 1.10578 |
| Topological Polar Surface Area | 68.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 242.11676 |
| Heavy Atoms | 18 |
| Complexity | 497.47256 |
Chemical Identifiers
| CAS Number | 338779-05-8 |
|---|---|
| SMILES | CN(C)C=C(C#N)C(=O)NN=CC1=CC=CC=C1 |
Product Overview
2-cyano-3-(dimethylamino)-N'-(phenylmethylidene)prop-2-enehydrazide (CAS 338779-05-8), with molecular formula C13H14N4O and molecular weight 242.12 g/mol. IUPAC: N-(benzylideneamino)-2-cyano-3-(dimethylamino)prop-2-enamide.
Chemical Property Profile of 2-cyano-3-(dimethylamino)-N'-(phenylmethylidene)prop-2-enehydrazide
Property Insights of 2-cyano-3-(dimethylamino)-N'-(phenylmethylidene)prop-2-enehydrazide
The XLogP value of 1.10578 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-cyano-3-(dimethylamino)-N'-(phenylmethylidene)prop-2-enehydrazide. The TPSA of 68.49 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-cyano-3-(dimethylamino)-N'-(phenylmethylidene)prop-2-enehydrazide. Following Lipinski's Rule of Five, 2-cyano-3-(dimethylamino)-N'-(phenylmethylidene)prop-2-enehydrazide 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 2-cyano-3-(dimethylamino)-N'-(phenylmethylidene)prop-2-enehydrazide?
The CAS number of 2-cyano-3-(dimethylamino)-N'-(phenylmethylidene)prop-2-enehydrazide is 338779-05-8.
What is the molecular formula of 2-cyano-3-(dimethylamino)-N'-(phenylmethylidene)prop-2-enehydrazide?
The molecular formula of 2-cyano-3-(dimethylamino)-N'-(phenylmethylidene)prop-2-enehydrazide is C13H14N4O.
What is the molecular weight of 2-cyano-3-(dimethylamino)-N'-(phenylmethylidene)prop-2-enehydrazide?
The molecular weight of 2-cyano-3-(dimethylamino)-N'-(phenylmethylidene)prop-2-enehydrazide is 242.12 g/mol.
Where can I buy 2-cyano-3-(dimethylamino)-N'-(phenylmethylidene)prop-2-enehydrazide?
You can request a quote for 2-cyano-3-(dimethylamino)-N'-(phenylmethylidene)prop-2-enehydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-cyano-3-(dimethylamino)-N'-(phenylmethylidene)prop-2-enehydrazide?
Yes, KEHONG BIO provides custom synthesis services for 2-cyano-3-(dimethylamino)-N'-(phenylmethylidene)prop-2-enehydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.