5-(1-aza-2-(3,5-bis(tert-butyl)-4-hydroxyphenyl)vinyl)-4-imino-2-oxo-3-phenyl-1H-1,3-diazine-6-carbonitrile
TL;DR: 5-(1-aza-2-(3,5-bis(tert-butyl)-4-hydroxyphenyl)vinyl)-4-imino-2-oxo-3-phenyl-1H-1,3-diazine-6-carbonitrile (CAS 1274947-84-0) is a chemical compound with molecular formula C26H29N5O2 and molecular weight 443.23212 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-amino-5-[(3,5-ditert-butyl-4-hydroxyphenyl)methylideneamino]-2-oxo-1-phenylpyrimidine-4-carbonitrile
Also Known As: 5-(1-aza-2-(3,5-bis(tert-butyl)-4-hydroxyphenyl)vinyl)-4-imino-2-oxo-3-phenyl-1H-1,3-diazine-6-carbonitrile, 6-amino-5-[(3,5-ditert-butyl-4-hydroxyphenyl)methylideneamino]-2-oxo-1-phenylpyrimidine-4-carbonitrile, 5-[(E)-[(3,5-di-tert-butyl-4-hydroxyphenyl)methylidene]amino]-6-imino-2-oxo-1-phenyl-1,2,3,6-tetrahydropyrimidine-4-carbonitrile, 6-amino-5-[(3,5-ditert-butyl-4-hydroxy-phenyl)methyleneamino]-2-oxo-1-phenyl-pyrimidine-4-carbonitrile, 6-amino-5-[(3,5-ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-2-oxo-1-phenylpyrimidine-4-carbonitrile
Technical Specifications
| Molecular Formula | C26H29N5O2 |
| Molecular Weight | 443.23212 g/mol |
| XLogP | 5.2 |
| Topological Polar Surface Area (TPSA) | 115.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 443.23212 Da |
| Heavy Atoms | 33 |
| Complexity | 866.0 |
| SMILES | CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C=NC2=C(N(C(=O)N=C2C#N)C3=CC=CC=C3)N |
| InChIKey | PBAPJPNCZHEMLO-UHFFFAOYSA-N |
Chemical Property Profile of 5-(1-aza-2-(3,5-bis(tert-butyl)-4-hydroxyphenyl)vinyl)-4-imino-2-oxo-3-phenyl-1H-1,3-diazine-6-carbonitrile
Property Insights of 5-(1-aza-2-(3,5-bis(tert-butyl)-4-hydroxyphenyl)vinyl)-4-imino-2-oxo-3-phenyl-1H-1,3-diazine-6-carbonitrile
The XLogP value of 5.2 indicates that 5-(1-aza-2-(3,5-bis(tert-butyl)-4-hydroxyphenyl)vinyl)-4-imino-2-oxo-3-phenyl-1H-1,3-diazine-6-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(1-aza-2-(3,5-bis(tert-butyl)-4-hydroxyphenyl)vinyl)-4-imino-2-oxo-3-phenyl-1H-1,3-diazine-6-carbonitrile. Following Lipinski's Rule of Five, 5-(1-aza-2-(3,5-bis(tert-butyl)-4-hydroxyphenyl)vinyl)-4-imino-2-oxo-3-phenyl-1H-1,3-diazine-6-carbonitrile has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 5-(1-aza-2-(3,5-bis(tert-butyl)-4-hydroxyphenyl)vinyl)-4-imino-2-oxo-3-phenyl-1H-1,3-diazine-6-carbonitrile?
The CAS number of 5-(1-aza-2-(3,5-bis(tert-butyl)-4-hydroxyphenyl)vinyl)-4-imino-2-oxo-3-phenyl-1H-1,3-diazine-6-carbonitrile is 1274947-84-0.
What is the molecular formula of 5-(1-aza-2-(3,5-bis(tert-butyl)-4-hydroxyphenyl)vinyl)-4-imino-2-oxo-3-phenyl-1H-1,3-diazine-6-carbonitrile?
The molecular formula of 5-(1-aza-2-(3,5-bis(tert-butyl)-4-hydroxyphenyl)vinyl)-4-imino-2-oxo-3-phenyl-1H-1,3-diazine-6-carbonitrile is C26H29N5O2.
What is the molecular weight of 5-(1-aza-2-(3,5-bis(tert-butyl)-4-hydroxyphenyl)vinyl)-4-imino-2-oxo-3-phenyl-1H-1,3-diazine-6-carbonitrile?
The molecular weight of 5-(1-aza-2-(3,5-bis(tert-butyl)-4-hydroxyphenyl)vinyl)-4-imino-2-oxo-3-phenyl-1H-1,3-diazine-6-carbonitrile is 443.23212 g/mol.
Where can I buy 5-(1-aza-2-(3,5-bis(tert-butyl)-4-hydroxyphenyl)vinyl)-4-imino-2-oxo-3-phenyl-1H-1,3-diazine-6-carbonitrile?
You can request a quote for 5-(1-aza-2-(3,5-bis(tert-butyl)-4-hydroxyphenyl)vinyl)-4-imino-2-oxo-3-phenyl-1H-1,3-diazine-6-carbonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-(1-aza-2-(3,5-bis(tert-butyl)-4-hydroxyphenyl)vinyl)-4-imino-2-oxo-3-phenyl-1H-1,3-diazine-6-carbonitrile?
Yes, CoreyChem provides custom synthesis services for 5-(1-aza-2-(3,5-bis(tert-butyl)-4-hydroxyphenyl)vinyl)-4-imino-2-oxo-3-phenyl-1H-1,3-diazine-6-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.