AB00668451-01
TL;DR: AB00668451-01 (CAS 958708-75-3) is a chemical compound with molecular formula C20H19N3O3S and molecular weight 381.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(4-methoxyphenyl)-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-2-methylbenzamide
Also Known As: AB00668451-01, F0561-0330, N-(2-(4-methoxyphenyl)-5-oxido-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)-2-methylbenzamide, N-[2-(4-methoxyphenyl)-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-2-methylbenzamide
| Molecular Formula | C20H19N3O3S |
|---|---|
| Molecular Weight | 381.11 g/mol |
| LogP | 3.20392 |
| Topological Polar Surface Area | 73.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 381.11472 |
| Heavy Atoms | 27 |
| Complexity | 1041.1255 |
Chemical Identifiers
| CAS Number | 958708-75-3 |
|---|---|
| SMILES | CC1=CC=CC=C1C(=O)NC2=C3CS(=O)CC3=NN2C4=CC=C(C=C4)OC |
Product Overview
AB00668451-01 (CAS 958708-75-3), with molecular formula C20H19N3O3S and molecular weight 381.11 g/mol. IUPAC: N-[2-(4-methoxyphenyl)-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-2-methylbenzamide.
Chemical Property Profile of AB00668451-01
Property Insights of AB00668451-01
The XLogP value of 3.20392 indicates that AB00668451-01 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 AB00668451-01. Following Lipinski's Rule of Five, AB00668451-01 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 AB00668451-01?
The CAS number of AB00668451-01 is 958708-75-3.
What is the molecular formula of AB00668451-01?
The molecular formula of AB00668451-01 is C20H19N3O3S.
What is the molecular weight of AB00668451-01?
The molecular weight of AB00668451-01 is 381.11 g/mol.
Where can I buy AB00668451-01?
You can request a quote for AB00668451-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00668451-01?
Yes, KEHONG BIO provides custom synthesis services for AB00668451-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.