AB00722101-01
TL;DR: AB00722101-01 (CAS 731838-68-9) is a chemical compound with molecular formula C20H23NO5 and molecular weight 357.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[1-(1-methoxypropan-2-yl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 4-formylbenzoate
Also Known As: AB00722101-01, [2-[1-(1-methoxypropan-2-yl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 4-formylbenzoate, 2-[1-(1-methoxypropan-2-yl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-oxoethyl 4-formylbenzoate
| Molecular Formula | C20H23NO5 |
|---|---|
| Molecular Weight | 357.16 g/mol |
| LogP | 3.16454 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 357.15762 |
| Heavy Atoms | 26 |
| Complexity | 804.3542 |
Chemical Identifiers
| CAS Number | 731838-68-9 |
|---|---|
| SMILES | CC1=CC(=C(N1C(C)COC)C)C(=O)COC(=O)C2=CC=C(C=C2)C=O |
Product Overview
AB00722101-01 (CAS 731838-68-9), with molecular formula C20H23NO5 and molecular weight 357.16 g/mol. IUPAC: [2-[1-(1-methoxypropan-2-yl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 4-formylbenzoate.
Chemical Property Profile of AB00722101-01
Property Insights of AB00722101-01
The XLogP value of 3.16454 indicates that AB00722101-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00722101-01. Following Lipinski's Rule of Five, AB00722101-01 has 0 hydrogen bond donor(s) and 5 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 AB00722101-01?
The CAS number of AB00722101-01 is 731838-68-9.
What is the molecular formula of AB00722101-01?
The molecular formula of AB00722101-01 is C20H23NO5.
What is the molecular weight of AB00722101-01?
The molecular weight of AB00722101-01 is 357.16 g/mol.
Where can I buy AB00722101-01?
You can request a quote for AB00722101-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00722101-01?
Yes, KEHONG BIO provides custom synthesis services for AB00722101-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.