AB00686106-01
TL;DR: AB00686106-01 (CAS 98052-96-1) is a chemical compound with molecular formula C16H17N7O3S and molecular weight 387.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4,6-dimethylpyrimidin-2-yl)-4-[(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)diazenyl]benzenesulfonamide
Also Known As: AB00686106-01, F1519-1214, (Z)-N-(4,6-dimethylpyrimidin-2-yl)-4-(2-(3-methyl-5-oxo-1H-pyrazol-4(5H)-ylidene)hydrazinyl)benzenesulfonamide, N-(4,6-dimethylpyrimidin-2-yl)-4-{2-[(4Z)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-4-ylidene]hydrazin-1-yl}benzene-1-sulfonamide, N-(4,6-dimethyl-2-pyrimidinyl)-4-[2-(3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene)hydrazino]benzenesulfonamide
| Molecular Formula | C16H17N7O3S |
|---|---|
| Molecular Weight | 387.11 g/mol |
| LogP | 2.63446 |
| Topological Polar Surface Area | 145.32 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 387.11136 |
| Heavy Atoms | 27 |
| Complexity | 1141.2197 |
Chemical Identifiers
| CAS Number | 98052-96-1 |
|---|---|
| SMILES | CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)N=NC3=C(NNC3=O)C)C |
Product Overview
AB00686106-01 (CAS 98052-96-1), with molecular formula C16H17N7O3S and molecular weight 387.11 g/mol. IUPAC: N-(4,6-dimethylpyrimidin-2-yl)-4-[(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)diazenyl]benzenesulfonamide.
Chemical Property Profile of AB00686106-01
Property Insights of AB00686106-01
The XLogP value of 2.63446 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00686106-01. The TPSA of 145.32 Ų indicates high polarity, suggesting AB00686106-01 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, AB00686106-01 has 3 hydrogen bond donor(s) and 7 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 AB00686106-01?
The CAS number of AB00686106-01 is 98052-96-1.
What is the molecular formula of AB00686106-01?
The molecular formula of AB00686106-01 is C16H17N7O3S.
What is the molecular weight of AB00686106-01?
The molecular weight of AB00686106-01 is 387.11 g/mol.
Where can I buy AB00686106-01?
You can request a quote for AB00686106-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00686106-01?
Yes, KEHONG BIO provides custom synthesis services for AB00686106-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.