starbld0005379
TL;DR: starbld0005379 (CAS 851712-59-9) is a chemical compound with molecular formula C25H19FN4O2S and molecular weight 458.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(cyanomethyl)-2-[3-[(4-fluorophenyl)methyl]-4-oxoquinazolin-2-yl]sulfanyl-N-phenylacetamide
Also Known As: starbld0005379, N-(cyanomethyl)-2-({3-[(4-fluorophenyl)methyl]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)-N-phenylacetamide, N-(Cyanomethyl)-2-((3-(4-fluorobenzyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N-phenylacetamide, N-(cyanomethyl)-2-[3-[(4-fluorophenyl)methyl]-4-oxo-quinazolin-2-yl]sulfanyl-N-phenyl-acetamide, N-(cyanomethyl)-2-[3-[(4-fluorophenyl)methyl]-4-oxoquinazolin-2-yl]sulfanyl-N-phenylacetamide
| Molecular Formula | C25H19FN4O2S |
|---|---|
| Molecular Weight | 458.12 g/mol |
| LogP | 4.23278 |
| Topological Polar Surface Area | 78.99 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 458.12128 |
| Heavy Atoms | 33 |
| Complexity | 1381.944 |
Chemical Identifiers
| CAS Number | 851712-59-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)N(CC#N)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC4=CC=C(C=C4)F |
Product Overview
starbld0005379 (CAS 851712-59-9), with molecular formula C25H19FN4O2S and molecular weight 458.12 g/mol. IUPAC: N-(cyanomethyl)-2-[3-[(4-fluorophenyl)methyl]-4-oxoquinazolin-2-yl]sulfanyl-N-phenylacetamide.
Chemical Property Profile of starbld0005379
Property Insights of starbld0005379
The XLogP value of 4.23278 indicates that starbld0005379 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.99 Ų falls within the moderate polarity range, balancing permeability and solubility for starbld0005379. Following Lipinski's Rule of Five, starbld0005379 has 0 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 starbld0005379?
The CAS number of starbld0005379 is 851712-59-9.
What is the molecular formula of starbld0005379?
The molecular formula of starbld0005379 is C25H19FN4O2S.
What is the molecular weight of starbld0005379?
The molecular weight of starbld0005379 is 458.12 g/mol.
Where can I buy starbld0005379?
You can request a quote for starbld0005379 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for starbld0005379?
Yes, KEHONG BIO provides custom synthesis services for starbld0005379 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.