2-((TERT-BUTYL)SULFONYL)-3-(3-METHOXY-4-((4-NITROPHENYL)METHOXY)PHENYL)PROP-2-ENENITRILE
TL;DR: 2-((TERT-BUTYL)SULFONYL)-3-(3-METHOXY-4-((4-NITROPHENYL)METHOXY)PHENYL)PROP-2-ENENITRILE (CAS 1025667-36-0) is a chemical compound with molecular formula C21H22N2O6S and molecular weight 430.11984 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-tert-butylsulfonyl-3-[3-methoxy-4-[(4-nitrophenyl)methoxy]phenyl]prop-2-enenitrile
Also Known As: 2-((TERT-BUTYL)SULFONYL)-3-(3-METHOXY-4-((4-NITROPHENYL)METHOXY)PHENYL)PROP-2-ENENITRILE, 2-tert-butylsulfonyl-3-[3-methoxy-4-[(4-nitrophenyl)methoxy]phenyl]prop-2-enenitrile, 3-[3-methoxy-4-[(4-nitrophenyl)methoxy]phenyl]-2-tert-butylsulfonyl-prop-2-enenitrile
Technical Specifications
| Molecular Formula | C21H22N2O6S |
| Molecular Weight | 430.11984 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 131.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 430.11984 Da |
| Heavy Atoms | 30 |
| Complexity | 773.0 |
| SMILES | CC(C)(C)S(=O)(=O)C(=CC1=CC(=C(C=C1)OCC2=CC=C(C=C2)[N+](=O)[O-])OC)C#N |
| InChIKey | AHMXZRSYPJVKBX-UHFFFAOYSA-N |
Chemical Property Profile of 2-((TERT-BUTYL)SULFONYL)-3-(3-METHOXY-4-((4-NITROPHENYL)METHOXY)PHENYL)PROP-2-ENENITRILE
Property Insights of 2-((TERT-BUTYL)SULFONYL)-3-(3-METHOXY-4-((4-NITROPHENYL)METHOXY)PHENYL)PROP-2-ENENITRILE
The XLogP value of 3.8 indicates that 2-((TERT-BUTYL)SULFONYL)-3-(3-METHOXY-4-((4-NITROPHENYL)METHOXY)PHENYL)PROP-2-ENENITRILE is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 131.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((TERT-BUTYL)SULFONYL)-3-(3-METHOXY-4-((4-NITROPHENYL)METHOXY)PHENYL)PROP-2-ENENITRILE. Following Lipinski's Rule of Five, 2-((TERT-BUTYL)SULFONYL)-3-(3-METHOXY-4-((4-NITROPHENYL)METHOXY)PHENYL)PROP-2-ENENITRILE has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-((TERT-BUTYL)SULFONYL)-3-(3-METHOXY-4-((4-NITROPHENYL)METHOXY)PHENYL)PROP-2-ENENITRILE?
The CAS number of 2-((TERT-BUTYL)SULFONYL)-3-(3-METHOXY-4-((4-NITROPHENYL)METHOXY)PHENYL)PROP-2-ENENITRILE is 1025667-36-0.
What is the molecular formula of 2-((TERT-BUTYL)SULFONYL)-3-(3-METHOXY-4-((4-NITROPHENYL)METHOXY)PHENYL)PROP-2-ENENITRILE?
The molecular formula of 2-((TERT-BUTYL)SULFONYL)-3-(3-METHOXY-4-((4-NITROPHENYL)METHOXY)PHENYL)PROP-2-ENENITRILE is C21H22N2O6S.
What is the molecular weight of 2-((TERT-BUTYL)SULFONYL)-3-(3-METHOXY-4-((4-NITROPHENYL)METHOXY)PHENYL)PROP-2-ENENITRILE?
The molecular weight of 2-((TERT-BUTYL)SULFONYL)-3-(3-METHOXY-4-((4-NITROPHENYL)METHOXY)PHENYL)PROP-2-ENENITRILE is 430.11984 g/mol.
Where can I buy 2-((TERT-BUTYL)SULFONYL)-3-(3-METHOXY-4-((4-NITROPHENYL)METHOXY)PHENYL)PROP-2-ENENITRILE?
You can request a quote for 2-((TERT-BUTYL)SULFONYL)-3-(3-METHOXY-4-((4-NITROPHENYL)METHOXY)PHENYL)PROP-2-ENENITRILE directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-((TERT-BUTYL)SULFONYL)-3-(3-METHOXY-4-((4-NITROPHENYL)METHOXY)PHENYL)PROP-2-ENENITRILE?
Yes, CoreyChem provides custom synthesis services for 2-((TERT-BUTYL)SULFONYL)-3-(3-METHOXY-4-((4-NITROPHENYL)METHOXY)PHENYL)PROP-2-ENENITRILE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.