AB00091043-01
TL;DR: AB00091043-01 (CAS 370073-17-9) is a chemical compound with molecular formula C20H15ClN2O2S and molecular weight 382.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(4-chlorophenyl)-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Also Known As: AB00091043-01, (2E)-3-(4-chlorophenyl)-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile, (E)-3-(4-chlorophenyl)-2-(4-(3,4-dimethoxyphenyl)thiazol-2-yl)acrylonitrile, (E)-3-(4-chlorophenyl)-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile, 3-(4-chlorophenyl)-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]acrylonitrile
| Molecular Formula | C20H15ClN2O2S |
|---|---|
| Molecular Weight | 382.05 g/mol |
| LogP | 5.54488 |
| Topological Polar Surface Area | 55.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 382.0543 |
| Heavy Atoms | 26 |
| Complexity | 987.79095 |
Chemical Identifiers
| CAS Number | 370073-17-9 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2=CSC(=N2)/C(=C/C3=CC=C(C=C3)Cl)/C#N)OC |
Product Overview
AB00091043-01 (CAS 370073-17-9), with molecular formula C20H15ClN2O2S and molecular weight 382.05 g/mol. IUPAC: (E)-3-(4-chlorophenyl)-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile.
Chemical Property Profile of AB00091043-01
Property Insights of AB00091043-01
The XLogP value of 5.54488 indicates that AB00091043-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.14 Ų, AB00091043-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00091043-01 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 AB00091043-01?
The CAS number of AB00091043-01 is 370073-17-9.
What is the molecular formula of AB00091043-01?
The molecular formula of AB00091043-01 is C20H15ClN2O2S.
What is the molecular weight of AB00091043-01?
The molecular weight of AB00091043-01 is 382.05 g/mol.
Where can I buy AB00091043-01?
You can request a quote for AB00091043-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00091043-01?
Yes, KEHONG BIO provides custom synthesis services for AB00091043-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.