ChemDiv1_008950
TL;DR: ChemDiv1_008950 (CAS 354119-10-1) is a chemical compound with molecular formula C25H26N6O3S2 and molecular weight 522.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-4-thia-2-azatricyclo[7.5.0.03,7]tetradeca-1,3(7),5,8-tetraene-5-carboxamide
Also Known As: ChemDiv1_008950, AN-919/15231379, A2743/0116534, 3-Amino-N-(4-(N-(4,6-dimethylpyrimidin-2-yl)sulfamoyl)phenyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]thieno[3,2-e]pyridine-2-carboxamide, 3-amino-N-(4-{[(4,6-dimethyl-2-pyrimidinyl)amino]sulfonyl}phenyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]thieno[3,2-e]pyridine-2-carboxamide
| Molecular Formula | C25H26N6O3S2 |
|---|---|
| Molecular Weight | 522.15 g/mol |
| LogP | 4.60734 |
| Topological Polar Surface Area | 139.96 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 522.15076 |
| Heavy Atoms | 36 |
| Complexity | 1559.6351 |
Chemical Identifiers
| CAS Number | 354119-10-1 |
|---|---|
| SMILES | CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=C(C4=C(S3)N=C5CCCCCC5=C4)N)C |
Product Overview
ChemDiv1_008950 (CAS 354119-10-1), with molecular formula C25H26N6O3S2 and molecular weight 522.15 g/mol. IUPAC: 6-amino-N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-4-thia-2-azatricyclo[7.5.0.03,7]tetradeca-1,3(7),5,8-tetraene-5-carboxamide.
Chemical Property Profile of ChemDiv1_008950
Property Insights of ChemDiv1_008950
The XLogP value of 4.60734 indicates that ChemDiv1_008950 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 139.96 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_008950. Following Lipinski's Rule of Five, ChemDiv1_008950 has 3 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 ChemDiv1_008950?
The CAS number of ChemDiv1_008950 is 354119-10-1.
What is the molecular formula of ChemDiv1_008950?
The molecular formula of ChemDiv1_008950 is C25H26N6O3S2.
What is the molecular weight of ChemDiv1_008950?
The molecular weight of ChemDiv1_008950 is 522.15 g/mol.
Where can I buy ChemDiv1_008950?
You can request a quote for ChemDiv1_008950 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_008950?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_008950 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.