AB00095168-01
TL;DR: AB00095168-01 (CAS 328540-47-2) is a chemical compound with molecular formula C21H19N3O2 and molecular weight 345.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-1-(2,4-dimethylpyrazolo[1,5-a]benzimidazol-3-yl)-3-(4-methoxyphenyl)prop-2-en-1-one
Also Known As: AB00095168-01, (E)-1-(2,4-dimethylpyrazolo[1,5-a]benzimidazol-3-yl)-3-(4-methoxyphenyl)prop-2-en-1-one, (2E)-1-(2,4-dimethyl-4H-pyrazolo[1,5-a]benzimidazol-3-yl)-3-(4-methoxyphenyl)prop-2-en-1-one, (E)-1-(2,4-dimethyl-4H-benzo[4,5]imidazo[1,2-b]pyrazol-3-yl)-3-(4-methoxyphenyl)prop-2-en-1-one
| Molecular Formula | C21H19N3O2 |
|---|---|
| Molecular Weight | 345.15 g/mol |
| LogP | 4.03912 |
| Topological Polar Surface Area | 48.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 345.14774 |
| Heavy Atoms | 26 |
| Complexity | 1147.6492 |
Chemical Identifiers
| CAS Number | 328540-47-2 |
|---|---|
| SMILES | CC1=NN2C3=CC=CC=C3N(C2=C1C(=O)/C=C/C4=CC=C(C=C4)OC)C |
Product Overview
AB00095168-01 (CAS 328540-47-2), with molecular formula C21H19N3O2 and molecular weight 345.15 g/mol. IUPAC: (E)-1-(2,4-dimethylpyrazolo[1,5-a]benzimidazol-3-yl)-3-(4-methoxyphenyl)prop-2-en-1-one.
Chemical Property Profile of AB00095168-01
Property Insights of AB00095168-01
The XLogP value of 4.03912 indicates that AB00095168-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.53 Ų, AB00095168-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00095168-01 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00095168-01?
The CAS number of AB00095168-01 is 328540-47-2.
What is the molecular formula of AB00095168-01?
The molecular formula of AB00095168-01 is C21H19N3O2.
What is the molecular weight of AB00095168-01?
The molecular weight of AB00095168-01 is 345.15 g/mol.
Where can I buy AB00095168-01?
You can request a quote for AB00095168-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00095168-01?
Yes, KEHONG BIO provides custom synthesis services for AB00095168-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.