CBKinase1_004884
TL;DR: CBKinase1_004884 (CAS 577763-08-7) is a chemical compound with molecular formula C17H18N4OS and molecular weight 326.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(1,2,3,4-tetrahydrocarbazol-9-yl)ethanone
Also Known As: CBKinase1_004884, CBKinase1_017284, BAS 06911109, 2-[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-(1,2,3,4-tetrahydro-9H-carbazol-9-yl)ethanone, BRD-K36404325-001-01-3
| Molecular Formula | C17H18N4OS |
|---|---|
| Molecular Weight | 326.12 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 88.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 326.12012 |
| Heavy Atoms | 23 |
| Complexity | 448.0 |
Chemical Identifiers
| CAS Number | 577763-08-7 |
|---|---|
| SMILES | CC1=NC(=NN1)SCC(=O)N2C3=C(CCCC3)C4=CC=CC=C42 |
| InChIKey | RKHGGZWIABMBRI-UHFFFAOYSA-N |
Product Overview
CBKinase1_004884 (CAS 577763-08-7), with molecular formula C17H18N4OS and molecular weight 326.12 g/mol. IUPAC: 2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(1,2,3,4-tetrahydrocarbazol-9-yl)ethanone.
Chemical Property Profile of CBKinase1_004884
Property Insights of CBKinase1_004884
The XLogP value of 4.1 indicates that CBKinase1_004884 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.9 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_004884. Following Lipinski's Rule of Five, CBKinase1_004884 has 1 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_004884?
The CAS number of CBKinase1_004884 is 577763-08-7.
What is the molecular formula of CBKinase1_004884?
The molecular formula of CBKinase1_004884 is C17H18N4OS.
What is the molecular weight of CBKinase1_004884?
The molecular weight of CBKinase1_004884 is 326.12 g/mol.
Where can I buy CBKinase1_004884?
You can request a quote for CBKinase1_004884 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_004884?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_004884 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.