CBKinase1_010958
TL;DR: CBKinase1_010958 (CAS 496779-02-3) is a chemical compound with molecular formula C20H21N5S and molecular weight 363.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(1H-benzimidazol-2-yl)ethyl]-7-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine
Also Known As: CBKinase1_010958, CBKinase1_023358, BRD-A92537180-001-01-7, F3098-5496, N-[2-(1H-1,3-benzodiazol-2-yl)ethyl]-11-methyl-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),3,5-tetraen-3-amine
| Molecular Formula | C20H21N5S |
|---|---|
| Molecular Weight | 363.15 g/mol |
| LogP | 4.347 |
| Topological Polar Surface Area | 66.49 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 363.15176 |
| Heavy Atoms | 26 |
| Complexity | 1047.3881 |
Chemical Identifiers
| CAS Number | 496779-02-3 |
|---|---|
| SMILES | CC1CCC2=C(C1)SC3=NC=NC(=C23)NCCC4=NC5=CC=CC=C5N4 |
Product Overview
CBKinase1_010958 (CAS 496779-02-3), with molecular formula C20H21N5S and molecular weight 363.15 g/mol. IUPAC: N-[2-(1H-benzimidazol-2-yl)ethyl]-7-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine.
Chemical Property Profile of CBKinase1_010958
Property Insights of CBKinase1_010958
The XLogP value of 4.347 indicates that CBKinase1_010958 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.49 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_010958. Following Lipinski's Rule of Five, CBKinase1_010958 has 2 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_010958?
The CAS number of CBKinase1_010958 is 496779-02-3.
What is the molecular formula of CBKinase1_010958?
The molecular formula of CBKinase1_010958 is C20H21N5S.
What is the molecular weight of CBKinase1_010958?
The molecular weight of CBKinase1_010958 is 363.15 g/mol.
Where can I buy CBKinase1_010958?
You can request a quote for CBKinase1_010958 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_010958?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_010958 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.