CBKinase1_009623
TL;DR: CBKinase1_009623 (CAS 685134-67-2) is a chemical compound with molecular formula C19H16N2O5 and molecular weight 352.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-(1,3-dioxoisoindol-2-yl)propanoylamino]-2-methylbenzoic acid
Also Known As: CBKinase1_009623, CBKinase1_022023, BRD-K59660884-001-01-5, 3-(3-(1,3-dioxoisoindolin-2-yl)propanamido)-2-methylbenzoic acid, 3-[3-(1,3-dioxoisoindol-2-yl)propanoylamino]-2-methylbenzoic acid
| Molecular Formula | C19H16N2O5 |
|---|---|
| Molecular Weight | 352.11 g/mol |
| LogP | 2.31802 |
| Topological Polar Surface Area | 103.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 352.10593 |
| Heavy Atoms | 26 |
| Complexity | 900.2768 |
Chemical Identifiers
| CAS Number | 685134-67-2 |
|---|---|
| SMILES | CC1=C(C=CC=C1NC(=O)CCN2C(=O)C3=CC=CC=C3C2=O)C(=O)O |
Product Overview
CBKinase1_009623 (CAS 685134-67-2), with molecular formula C19H16N2O5 and molecular weight 352.11 g/mol. IUPAC: 3-[3-(1,3-dioxoisoindol-2-yl)propanoylamino]-2-methylbenzoic acid.
Chemical Property Profile of CBKinase1_009623
Property Insights of CBKinase1_009623
The XLogP value of 2.31802 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CBKinase1_009623. The TPSA of 103.78 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_009623. Following Lipinski's Rule of Five, CBKinase1_009623 has 2 hydrogen bond donor(s) and 4 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 CBKinase1_009623?
The CAS number of CBKinase1_009623 is 685134-67-2.
What is the molecular formula of CBKinase1_009623?
The molecular formula of CBKinase1_009623 is C19H16N2O5.
What is the molecular weight of CBKinase1_009623?
The molecular weight of CBKinase1_009623 is 352.11 g/mol.
Where can I buy CBKinase1_009623?
You can request a quote for CBKinase1_009623 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_009623?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_009623 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.