CBKinase1_008840
TL;DR: CBKinase1_008840 (CAS 710984-85-3) is a chemical compound with molecular formula C20H19N5S and molecular weight 361.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(3-methylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-benzimidazole
Also Known As: CBKinase1_008840, CBKinase1_021240, BRD-K16748323-001-01-9, 2-[[5-(3-methylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-benzimidazole, 2-(((4-allyl-5-(m-tolyl)-4H-1,2,4-triazol-3-yl)thio)methyl)-1H-benzo[d]imidazole
| Molecular Formula | C20H19N5S |
|---|---|
| Molecular Weight | 361.14 g/mol |
| LogP | 4.60812 |
| Topological Polar Surface Area | 59.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 361.1361 |
| Heavy Atoms | 26 |
| Complexity | 1029.9519 |
Chemical Identifiers
| CAS Number | 710984-85-3 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C2=NN=C(N2CC=C)SCC3=NC4=CC=CC=C4N3 |
Product Overview
CBKinase1_008840 (CAS 710984-85-3), with molecular formula C20H19N5S and molecular weight 361.14 g/mol. IUPAC: 2-[[5-(3-methylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-benzimidazole.
Chemical Property Profile of CBKinase1_008840
Property Insights of CBKinase1_008840
The XLogP value of 4.60812 indicates that CBKinase1_008840 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.39 Ų, CBKinase1_008840 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CBKinase1_008840 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_008840?
The CAS number of CBKinase1_008840 is 710984-85-3.
What is the molecular formula of CBKinase1_008840?
The molecular formula of CBKinase1_008840 is C20H19N5S.
What is the molecular weight of CBKinase1_008840?
The molecular weight of CBKinase1_008840 is 361.14 g/mol.
Where can I buy CBKinase1_008840?
You can request a quote for CBKinase1_008840 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_008840?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_008840 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.