EiM07-17598
TL;DR: EiM07-17598 (CAS 899388-84-2) is a chemical compound with molecular formula C21H28N4O4 and molecular weight 400.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[6-(4-oxo-1,2,3-benzotriazin-3-yl)hexanoylamino]methyl]cyclohexane-1-carboxylic acid
Also Known As: EiM07-17598, 4-((6-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)hexanamido)methyl)cyclohexanecarboxylic acid, 4-[[6-(4-oxo-1,2,3-benzotriazin-3-yl)hexanoylamino]methyl]cyclohexane-1-carboxylic acid, 4-{[6-(4-OXO-3,4-DIHYDRO-1,2,3-BENZOTRIAZIN-3-YL)HEXANAMIDO]METHYL}CYCLOHEXANE-1-CARBOXYLIC ACID, trans-4-({[6-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)hexanoyl]amino}methyl)cyclohexanecarboxylic acid
| Molecular Formula | C21H28N4O4 |
|---|---|
| Molecular Weight | 400.21 g/mol |
| LogP | 2.3591 |
| Topological Polar Surface Area | 114.18 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 400.21106 |
| Heavy Atoms | 29 |
| Complexity | 902.9344 |
Chemical Identifiers
| CAS Number | 899388-84-2 |
|---|---|
| SMILES | C1CC(CCC1CNC(=O)CCCCCN2C(=O)C3=CC=CC=C3N=N2)C(=O)O |
Product Overview
EiM07-17598 (CAS 899388-84-2), with molecular formula C21H28N4O4 and molecular weight 400.21 g/mol. IUPAC: 4-[[6-(4-oxo-1,2,3-benzotriazin-3-yl)hexanoylamino]methyl]cyclohexane-1-carboxylic acid.
Chemical Property Profile of EiM07-17598
Property Insights of EiM07-17598
The XLogP value of 2.3591 suggests moderate lipophilicity, balancing water solubility and membrane permeability for EiM07-17598. The TPSA of 114.18 Ų falls within the moderate polarity range, balancing permeability and solubility for EiM07-17598. Following Lipinski's Rule of Five, EiM07-17598 has 2 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 EiM07-17598?
The CAS number of EiM07-17598 is 899388-84-2.
What is the molecular formula of EiM07-17598?
The molecular formula of EiM07-17598 is C21H28N4O4.
What is the molecular weight of EiM07-17598?
The molecular weight of EiM07-17598 is 400.21 g/mol.
Where can I buy EiM07-17598?
You can request a quote for EiM07-17598 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EiM07-17598?
Yes, KEHONG BIO provides custom synthesis services for EiM07-17598 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.