(Z)-3-(1,3-Benzodioxol-5-yl)-2-(phenothiazine-10-carbonyl)prop-2-enenitrile
TL;DR: (Z)-3-(1,3-Benzodioxol-5-yl)-2-(phenothiazine-10-carbonyl)prop-2-enenitrile (CAS 380560-79-2) is a chemical compound with molecular formula C23H14N2O3S and molecular weight 398.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-3-(1,3-benzodioxol-5-yl)-2-(phenothiazine-10-carbonyl)prop-2-enenitrile
Also Known As: (Z)-3-(1,3-Benzodioxol-5-yl)-2-(phenothiazine-10-carbonyl)prop-2-enenitrile, 3-(1,3-dioxaindan-5-yl)-2-(10H-phenothiazine-10-carbonyl)prop-2-enenitrile
| Molecular Formula | C23H14N2O3S |
|---|---|
| Molecular Weight | 398.07 g/mol |
| LogP | 5.15178 |
| Topological Polar Surface Area | 62.56 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 398.0725 |
| Heavy Atoms | 29 |
| Complexity | 1167.24 |
Chemical Identifiers
| CAS Number | 380560-79-2 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)/C=C(/C#N)\C(=O)N3C4=CC=CC=C4SC5=CC=CC=C53 |
Product Overview
(Z)-3-(1,3-Benzodioxol-5-yl)-2-(phenothiazine-10-carbonyl)prop-2-enenitrile (CAS 380560-79-2), with molecular formula C23H14N2O3S and molecular weight 398.07 g/mol. IUPAC: (Z)-3-(1,3-benzodioxol-5-yl)-2-(phenothiazine-10-carbonyl)prop-2-enenitrile.
Chemical Property Profile of (Z)-3-(1,3-Benzodioxol-5-yl)-2-(phenothiazine-10-carbonyl)prop-2-enenitrile
Property Insights of (Z)-3-(1,3-Benzodioxol-5-yl)-2-(phenothiazine-10-carbonyl)prop-2-enenitrile
The XLogP value of 5.15178 indicates that (Z)-3-(1,3-Benzodioxol-5-yl)-2-(phenothiazine-10-carbonyl)prop-2-enenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.56 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-3-(1,3-Benzodioxol-5-yl)-2-(phenothiazine-10-carbonyl)prop-2-enenitrile. Following Lipinski's Rule of Five, (Z)-3-(1,3-Benzodioxol-5-yl)-2-(phenothiazine-10-carbonyl)prop-2-enenitrile has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (Z)-3-(1,3-Benzodioxol-5-yl)-2-(phenothiazine-10-carbonyl)prop-2-enenitrile?
The CAS number of (Z)-3-(1,3-Benzodioxol-5-yl)-2-(phenothiazine-10-carbonyl)prop-2-enenitrile is 380560-79-2.
What is the molecular formula of (Z)-3-(1,3-Benzodioxol-5-yl)-2-(phenothiazine-10-carbonyl)prop-2-enenitrile?
The molecular formula of (Z)-3-(1,3-Benzodioxol-5-yl)-2-(phenothiazine-10-carbonyl)prop-2-enenitrile is C23H14N2O3S.
What is the molecular weight of (Z)-3-(1,3-Benzodioxol-5-yl)-2-(phenothiazine-10-carbonyl)prop-2-enenitrile?
The molecular weight of (Z)-3-(1,3-Benzodioxol-5-yl)-2-(phenothiazine-10-carbonyl)prop-2-enenitrile is 398.07 g/mol.
Where can I buy (Z)-3-(1,3-Benzodioxol-5-yl)-2-(phenothiazine-10-carbonyl)prop-2-enenitrile?
You can request a quote for (Z)-3-(1,3-Benzodioxol-5-yl)-2-(phenothiazine-10-carbonyl)prop-2-enenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-3-(1,3-Benzodioxol-5-yl)-2-(phenothiazine-10-carbonyl)prop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for (Z)-3-(1,3-Benzodioxol-5-yl)-2-(phenothiazine-10-carbonyl)prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.