CBKinase1_000243
TL;DR: CBKinase1_000243 (CAS 369606-61-1) is a chemical compound with molecular formula C13H14N2O3S and molecular weight 278.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)ethanone
Also Known As: CBKinase1_000243, CBKinase1_012643, BAS 00334030, 1-(2,3-dihydro-1,4-benzodioxin-2-yl)-2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)ethanone, 1-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)ethanone
| Molecular Formula | C13H14N2O3S |
|---|---|
| Molecular Weight | 278.07 g/mol |
| LogP | 1.0879 |
| Topological Polar Surface Area | 59.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 278.0725 |
| Heavy Atoms | 19 |
| Complexity | 518.36475 |
Chemical Identifiers
| CAS Number | 369606-61-1 |
|---|---|
| SMILES | C1CN=C(N1)SCC(=O)C2COC3=CC=CC=C3O2 |
Product Overview
CBKinase1_000243 (CAS 369606-61-1), with molecular formula C13H14N2O3S and molecular weight 278.07 g/mol. IUPAC: 1-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)ethanone.
Chemical Property Profile of CBKinase1_000243
Property Insights of CBKinase1_000243
The XLogP value of 1.0879 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CBKinase1_000243. With a topological polar surface area (TPSA) of 59.92 Ų, CBKinase1_000243 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CBKinase1_000243 has 1 hydrogen bond donor(s) and 6 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_000243?
The CAS number of CBKinase1_000243 is 369606-61-1.
What is the molecular formula of CBKinase1_000243?
The molecular formula of CBKinase1_000243 is C13H14N2O3S.
What is the molecular weight of CBKinase1_000243?
The molecular weight of CBKinase1_000243 is 278.07 g/mol.
Where can I buy CBKinase1_000243?
You can request a quote for CBKinase1_000243 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_000243?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_000243 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.