AB00670412-01
TL;DR: AB00670412-01 (CAS 851949-85-4) is a chemical compound with molecular formula C24H21FN4O6S2 and molecular weight 544.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-[[4-(dimethylsulfamoyl)benzoyl]amino]-3-(4-fluorophenyl)-4-oxothieno[3,4-d]pyridazine-1-carboxylate
Also Known As: AB00670412-01, F0641-0366, ethyl 5-[4-(dimethylsulfamoyl)benzamido]-3-(4-fluorophenyl)-4-oxo-3H,4H-thieno[3,4-d]pyridazine-1-carboxylate, ethyl 5-(4-(N,N-dimethylsulfamoyl)benzamido)-3-(4-fluorophenyl)-4-oxo-3,4-dihydrothieno[3,4-d]pyridazine-1-carboxylate, ethyl 5-[[4-(dimethylsulfamoyl)benzoyl]amino]-3-(4-fluorophenyl)-4-oxothieno[3,4-d]pyridazine-1-carboxylate
| Molecular Formula | C24H21FN4O6S2 |
|---|---|
| Molecular Weight | 544.09 g/mol |
| LogP | 3.2656 |
| Topological Polar Surface Area | 127.67 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 544.0887 |
| Heavy Atoms | 37 |
| Complexity | 1660.6301 |
Chemical Identifiers
| CAS Number | 851949-85-4 |
|---|---|
| SMILES | CCOC(=O)C1=NN(C(=O)C2=C(SC=C21)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N(C)C)C4=CC=C(C=C4)F |
Product Overview
AB00670412-01 (CAS 851949-85-4), with molecular formula C24H21FN4O6S2 and molecular weight 544.09 g/mol. IUPAC: ethyl 5-[[4-(dimethylsulfamoyl)benzoyl]amino]-3-(4-fluorophenyl)-4-oxothieno[3,4-d]pyridazine-1-carboxylate.
Chemical Property Profile of AB00670412-01
Property Insights of AB00670412-01
The XLogP value of 3.2656 indicates that AB00670412-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 127.67 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00670412-01. Following Lipinski's Rule of Five, AB00670412-01 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00670412-01?
The CAS number of AB00670412-01 is 851949-85-4.
What is the molecular formula of AB00670412-01?
The molecular formula of AB00670412-01 is C24H21FN4O6S2.
What is the molecular weight of AB00670412-01?
The molecular weight of AB00670412-01 is 544.09 g/mol.
Where can I buy AB00670412-01?
You can request a quote for AB00670412-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00670412-01?
Yes, KEHONG BIO provides custom synthesis services for AB00670412-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.