CBKinase1_002152
TL;DR: CBKinase1_002152 (CAS 693229-81-1) is a chemical compound with molecular formula C23H22N4OS and molecular weight 402.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1-(1,2,3,4-tetrahydrocarbazol-9-yl)ethanone
Also Known As: CBKinase1_002152, CBKinase1_014552, BRD-K28620749-001-01-2, 2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1-(1,2,3,4-tetrahydrocarbazol-9-yl)ethanone, 2-[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-(1,2,3,4-tetrahydro-9H-carbazol-9-yl)ethanone
| Molecular Formula | C23H22N4OS |
|---|---|
| Molecular Weight | 402.15 g/mol |
| LogP | 4.7481 |
| Topological Polar Surface Area | 52.71 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 402.15143 |
| Heavy Atoms | 29 |
| Complexity | 1192.5425 |
Chemical Identifiers
| CAS Number | 693229-81-1 |
|---|---|
| SMILES | CN1C(=NN=C1SCC(=O)N2C3=C(CCCC3)C4=CC=CC=C42)C5=CC=CC=C5 |
Product Overview
CBKinase1_002152 (CAS 693229-81-1), with molecular formula C23H22N4OS and molecular weight 402.15 g/mol. IUPAC: 2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1-(1,2,3,4-tetrahydrocarbazol-9-yl)ethanone.
Chemical Property Profile of CBKinase1_002152
Property Insights of CBKinase1_002152
The XLogP value of 4.7481 indicates that CBKinase1_002152 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.71 Ų, CBKinase1_002152 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CBKinase1_002152 has 0 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_002152?
The CAS number of CBKinase1_002152 is 693229-81-1.
What is the molecular formula of CBKinase1_002152?
The molecular formula of CBKinase1_002152 is C23H22N4OS.
What is the molecular weight of CBKinase1_002152?
The molecular weight of CBKinase1_002152 is 402.15 g/mol.
Where can I buy CBKinase1_002152?
You can request a quote for CBKinase1_002152 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_002152?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_002152 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.