CBKinase1_004376
TL;DR: CBKinase1_004376 (CAS 577787-68-9) is a chemical compound with molecular formula C17H15N7S2 and molecular weight 381.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-2-N-naphthalen-2-yl-1,3,5-triazine-2,4-diamine
Also Known As: CBKinase1_004376, CBKinase1_016776, BAS 06575940, BRD-K21181701-001-01-8, 6-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-N-(naphthalen-2-yl)-1,3,5-triazine-2,4-diamine
| Molecular Formula | C17H15N7S2 |
|---|---|
| Molecular Weight | 381.08 g/mol |
| LogP | 3.80282 |
| Topological Polar Surface Area | 102.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 381.08304 |
| Heavy Atoms | 26 |
| Complexity | 1063.8623 |
Chemical Identifiers
| CAS Number | 577787-68-9 |
|---|---|
| SMILES | CC1=NN=C(S1)SCC2=NC(=NC(=N2)NC3=CC4=CC=CC=C4C=C3)N |
Product Overview
CBKinase1_004376 (CAS 577787-68-9), with molecular formula C17H15N7S2 and molecular weight 381.08 g/mol. IUPAC: 6-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-2-N-naphthalen-2-yl-1,3,5-triazine-2,4-diamine.
Chemical Property Profile of CBKinase1_004376
Property Insights of CBKinase1_004376
The XLogP value of 3.80282 indicates that CBKinase1_004376 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.5 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_004376. Following Lipinski's Rule of Five, CBKinase1_004376 has 2 hydrogen bond donor(s) and 9 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_004376?
The CAS number of CBKinase1_004376 is 577787-68-9.
What is the molecular formula of CBKinase1_004376?
The molecular formula of CBKinase1_004376 is C17H15N7S2.
What is the molecular weight of CBKinase1_004376?
The molecular weight of CBKinase1_004376 is 381.08 g/mol.
Where can I buy CBKinase1_004376?
You can request a quote for CBKinase1_004376 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_004376?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_004376 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.