ChemDiv3_006909
TL;DR: ChemDiv3_006909 (CAS 702646-06-8) is a chemical compound with molecular formula C24H27N5O2S and molecular weight 449.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-cyclohexyl-N,4-dimethyl-3-(6-methyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)benzenesulfonamide
Also Known As: ChemDiv3_006909, IDI1_024819, BRD-K29226364-001-01-1, N-cyclohexyl-N,4-dimethyl-3-(6-methyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)benzenesulfonamide, N-cyclohexyl-N,4-dimethyl-3-(6-methyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)benzenesulfonamide
| Molecular Formula | C24H27N5O2S |
|---|---|
| Molecular Weight | 449.19 g/mol |
| LogP | 4.51454 |
| Topological Polar Surface Area | 80.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 449.18854 |
| Heavy Atoms | 32 |
| Complexity | 1421.3802 |
Chemical Identifiers
| CAS Number | 702646-06-8 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)S(=O)(=O)N(C)C2CCCCC2)C3=NN=C4N3N=C(C5=CC=CC=C54)C |
Product Overview
ChemDiv3_006909 (CAS 702646-06-8), with molecular formula C24H27N5O2S and molecular weight 449.19 g/mol. IUPAC: N-cyclohexyl-N,4-dimethyl-3-(6-methyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)benzenesulfonamide.
Chemical Property Profile of ChemDiv3_006909
Property Insights of ChemDiv3_006909
The XLogP value of 4.51454 indicates that ChemDiv3_006909 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.46 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_006909. Following Lipinski's Rule of Five, ChemDiv3_006909 has 0 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 ChemDiv3_006909?
The CAS number of ChemDiv3_006909 is 702646-06-8.
What is the molecular formula of ChemDiv3_006909?
The molecular formula of ChemDiv3_006909 is C24H27N5O2S.
What is the molecular weight of ChemDiv3_006909?
The molecular weight of ChemDiv3_006909 is 449.19 g/mol.
Where can I buy ChemDiv3_006909?
You can request a quote for ChemDiv3_006909 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_006909?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_006909 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.