AB00873504-06
TL;DR: AB00873504-06 (CAS 681265-72-5) is a chemical compound with molecular formula C21H21N3O4S and molecular weight 411.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5,5-dioxo-2-phenyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-4-propan-2-yloxybenzamide
Also Known As: AB00873504-06, F0541-0145, N-(5,5-dioxido-2-phenyl-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)-4-isopropoxybenzamide, N-(5,5-dioxo-2-phenyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-4-propan-2-yloxybenzamide, N-{5,5-dioxo-2-phenyl-2H,4H,6H-5lambda6-thieno[3,4-c]pyrazol-3-yl}-4-(propan-2-yloxy)benzamide
| Molecular Formula | C21H21N3O4S |
|---|---|
| Molecular Weight | 411.13 g/mol |
| LogP | 3.3402 |
| Topological Polar Surface Area | 90.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 411.12527 |
| Heavy Atoms | 29 |
| Complexity | 1150.6418 |
Chemical Identifiers
| CAS Number | 681265-72-5 |
|---|---|
| SMILES | CC(C)OC1=CC=C(C=C1)C(=O)NC2=C3CS(=O)(=O)CC3=NN2C4=CC=CC=C4 |
Product Overview
AB00873504-06 (CAS 681265-72-5), with molecular formula C21H21N3O4S and molecular weight 411.13 g/mol. IUPAC: N-(5,5-dioxo-2-phenyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-4-propan-2-yloxybenzamide.
Chemical Property Profile of AB00873504-06
Property Insights of AB00873504-06
The XLogP value of 3.3402 indicates that AB00873504-06 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.29 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00873504-06. Following Lipinski's Rule of Five, AB00873504-06 has 1 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 AB00873504-06?
The CAS number of AB00873504-06 is 681265-72-5.
What is the molecular formula of AB00873504-06?
The molecular formula of AB00873504-06 is C21H21N3O4S.
What is the molecular weight of AB00873504-06?
The molecular weight of AB00873504-06 is 411.13 g/mol.
Where can I buy AB00873504-06?
You can request a quote for AB00873504-06 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00873504-06?
Yes, KEHONG BIO provides custom synthesis services for AB00873504-06 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.