AB00674527-01
TL;DR: AB00674527-01 (CAS 627072-69-9) is a chemical compound with molecular formula C20H11N3O3S2 and molecular weight 405.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-[5-(2-nitrophenyl)furan-2-yl]-2-(4-thiophen-2-yl-1,3-thiazol-2-yl)prop-2-enenitrile
Also Known As: AB00674527-01, (2E)-3-[5-(2-nitrophenyl)furan-2-yl]-2-[4-(thiophen-2-yl)-1,3-thiazol-2-yl]prop-2-enenitrile, F1529-0437, (E)-3-(5-(2-nitrophenyl)furan-2-yl)-2-(4-(thiophen-2-yl)thiazol-2-yl)acrylonitrile, (E)-3-[5-(2-nitrophenyl)furan-2-yl]-2-(4-thiophen-2-yl-1,3-thiazol-2-yl)prop-2-enenitrile
| Molecular Formula | C20H11N3O3S2 |
|---|---|
| Molecular Weight | 405.02 g/mol |
| LogP | 6.10398 |
| Topological Polar Surface Area | 92.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 405.02417 |
| Heavy Atoms | 28 |
| Complexity | 1213.548 |
Chemical Identifiers
| CAS Number | 627072-69-9 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C2=CC=C(O2)/C=C(\C#N)/C3=NC(=CS3)C4=CC=CS4)[N+](=O)[O-] |
Product Overview
AB00674527-01 (CAS 627072-69-9), with molecular formula C20H11N3O3S2 and molecular weight 405.02 g/mol. IUPAC: (E)-3-[5-(2-nitrophenyl)furan-2-yl]-2-(4-thiophen-2-yl-1,3-thiazol-2-yl)prop-2-enenitrile.
Chemical Property Profile of AB00674527-01
Property Insights of AB00674527-01
The XLogP value of 6.10398 indicates that AB00674527-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.96 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00674527-01. Following Lipinski's Rule of Five, AB00674527-01 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00674527-01?
The CAS number of AB00674527-01 is 627072-69-9.
What is the molecular formula of AB00674527-01?
The molecular formula of AB00674527-01 is C20H11N3O3S2.
What is the molecular weight of AB00674527-01?
The molecular weight of AB00674527-01 is 405.02 g/mol.
Where can I buy AB00674527-01?
You can request a quote for AB00674527-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00674527-01?
Yes, KEHONG BIO provides custom synthesis services for AB00674527-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.