CBKinase1_003132
TL;DR: CBKinase1_003132 (CAS 493027-65-9) is a chemical compound with molecular formula C17H14FN5O3S and molecular weight 387.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-fluorophenyl)-2-[[4-methyl-5-(4-nitrophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: CBKinase1_003132, CBKinase1_015532, BRD-K68301614-001-01-2, N-(4-fluorophenyl)-2-[[4-methyl-5-(4-nitrophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide, N-(4-fluorophenyl)-2-{[4-methyl-5-(4-nitrophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
| Molecular Formula | C17H14FN5O3S |
|---|---|
| Molecular Weight | 387.08 g/mol |
| LogP | 3.2602 |
| Topological Polar Surface Area | 102.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 387.08014 |
| Heavy Atoms | 27 |
| Complexity | 973.2389 |
Chemical Identifiers
| CAS Number | 493027-65-9 |
|---|---|
| SMILES | CN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)F)C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
CBKinase1_003132 (CAS 493027-65-9), with molecular formula C17H14FN5O3S and molecular weight 387.08 g/mol. IUPAC: N-(4-fluorophenyl)-2-[[4-methyl-5-(4-nitrophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of CBKinase1_003132
Property Insights of CBKinase1_003132
The XLogP value of 3.2602 indicates that CBKinase1_003132 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.95 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_003132. Following Lipinski's Rule of Five, CBKinase1_003132 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_003132?
The CAS number of CBKinase1_003132 is 493027-65-9.
What is the molecular formula of CBKinase1_003132?
The molecular formula of CBKinase1_003132 is C17H14FN5O3S.
What is the molecular weight of CBKinase1_003132?
The molecular weight of CBKinase1_003132 is 387.08 g/mol.
Where can I buy CBKinase1_003132?
You can request a quote for CBKinase1_003132 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_003132?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_003132 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.