AB00668445-01
TL;DR: AB00668445-01 (CAS 1007194-64-0) is a chemical compound with molecular formula C22H23N3O3S and molecular weight 409.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(2,4-dimethylphenyl)-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-2-ethoxybenzamide
Also Known As: AB00668445-01, F0561-0125, N-(2-(2,4-dimethylphenyl)-5-oxido-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)-2-ethoxybenzamide, N-[2-(2,4-dimethylphenyl)-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-2-ethoxybenzamide, N-[2-(2,4-dimethylphenyl)-5-oxo-2H,4H,6H-5lambda4-thieno[3,4-c]pyrazol-3-yl]-2-ethoxybenzamide
| Molecular Formula | C22H23N3O3S |
|---|---|
| Molecular Weight | 409.15 g/mol |
| LogP | 3.90244 |
| Topological Polar Surface Area | 73.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 409.14603 |
| Heavy Atoms | 29 |
| Complexity | 1120.4855 |
Chemical Identifiers
| CAS Number | 1007194-64-0 |
|---|---|
| SMILES | CCOC1=CC=CC=C1C(=O)NC2=C3CS(=O)CC3=NN2C4=C(C=C(C=C4)C)C |
Product Overview
AB00668445-01 (CAS 1007194-64-0), with molecular formula C22H23N3O3S and molecular weight 409.15 g/mol. IUPAC: N-[2-(2,4-dimethylphenyl)-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-2-ethoxybenzamide.
Chemical Property Profile of AB00668445-01
Property Insights of AB00668445-01
The XLogP value of 3.90244 indicates that AB00668445-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.22 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00668445-01. Following Lipinski's Rule of Five, AB00668445-01 has 1 hydrogen bond donor(s) and 4 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 AB00668445-01?
The CAS number of AB00668445-01 is 1007194-64-0.
What is the molecular formula of AB00668445-01?
The molecular formula of AB00668445-01 is C22H23N3O3S.
What is the molecular weight of AB00668445-01?
The molecular weight of AB00668445-01 is 409.15 g/mol.
Where can I buy AB00668445-01?
You can request a quote for AB00668445-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00668445-01?
Yes, KEHONG BIO provides custom synthesis services for AB00668445-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.