CBKinase1_003993
TL;DR: CBKinase1_003993 (CAS 686283-98-7) is a chemical compound with molecular formula C13H16N2OS2 and molecular weight 280.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(7-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)sulfanyl]ethanol
Also Known As: CBKinase1_003993, CBKinase1_016393, VU0047835-1, AP-906/41880914, BRD-A28433639-001-01-5
| Molecular Formula | C13H16N2OS2 |
|---|---|
| Molecular Weight | 280.07 g/mol |
| LogP | 2.9005 |
| Topological Polar Surface Area | 46.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 280.0704 |
| Heavy Atoms | 18 |
| Complexity | 567.36176 |
Chemical Identifiers
| CAS Number | 686283-98-7 |
|---|---|
| SMILES | CC1CCC2=C(C1)SC3=C2C(=NC=N3)SCCO |
Product Overview
CBKinase1_003993 (CAS 686283-98-7), with molecular formula C13H16N2OS2 and molecular weight 280.07 g/mol. IUPAC: 2-[(7-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)sulfanyl]ethanol.
Chemical Property Profile of CBKinase1_003993
Property Insights of CBKinase1_003993
The XLogP value of 2.9005 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CBKinase1_003993. With a topological polar surface area (TPSA) of 46.01 Ų, CBKinase1_003993 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CBKinase1_003993 has 1 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 CBKinase1_003993?
The CAS number of CBKinase1_003993 is 686283-98-7.
What is the molecular formula of CBKinase1_003993?
The molecular formula of CBKinase1_003993 is C13H16N2OS2.
What is the molecular weight of CBKinase1_003993?
The molecular weight of CBKinase1_003993 is 280.07 g/mol.
Where can I buy CBKinase1_003993?
You can request a quote for CBKinase1_003993 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_003993?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_003993 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.