F0916-5047
TL;DR: F0916-5047 (CAS 451464-79-2) is a chemical compound with molecular formula C27H26ClN3O2S and molecular weight 491.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-chlorophenyl)methyl]-4-[2-[(2-methylphenyl)methylsulfanyl]-4-oxoquinazolin-3-yl]butanamide
Also Known As: F0916-5047, N-[(3-chlorophenyl)methyl]-4-(2-{[(2-methylphenyl)methyl]sulfanyl}-4-oxo-3,4-dihydroquinazolin-3-yl)butanamide, N-(3-chlorobenzyl)-4-(2-((2-methylbenzyl)thio)-4-oxoquinazolin-3(4H)-yl)butanamide, N-[(3-chlorophenyl)methyl]-4-[2-[(2-methylphenyl)methylsulfanyl]-4-oxoquinazolin-3-yl]butanamide, N-[(3-chlorophenyl)methyl]-4-[2-[(2-methylphenyl)methylsulfanyl]-4-oxo-quinazolin-3-yl]butanamide
| Molecular Formula | C27H26ClN3O2S |
|---|---|
| Molecular Weight | 491.14 g/mol |
| LogP | 5.74722 |
| Topological Polar Surface Area | 63.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 491.14343 |
| Heavy Atoms | 34 |
| Complexity | 1369.5929 |
Chemical Identifiers
| CAS Number | 451464-79-2 |
|---|---|
| SMILES | CC1=CC=CC=C1CSC2=NC3=CC=CC=C3C(=O)N2CCCC(=O)NCC4=CC(=CC=C4)Cl |
Product Overview
F0916-5047 (CAS 451464-79-2), with molecular formula C27H26ClN3O2S and molecular weight 491.14 g/mol. IUPAC: N-[(3-chlorophenyl)methyl]-4-[2-[(2-methylphenyl)methylsulfanyl]-4-oxoquinazolin-3-yl]butanamide.
Chemical Property Profile of F0916-5047
Property Insights of F0916-5047
The XLogP value of 5.74722 indicates that F0916-5047 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.99 Ų falls within the moderate polarity range, balancing permeability and solubility for F0916-5047. Following Lipinski's Rule of Five, F0916-5047 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0916-5047?
The CAS number of F0916-5047 is 451464-79-2.
What is the molecular formula of F0916-5047?
The molecular formula of F0916-5047 is C27H26ClN3O2S.
What is the molecular weight of F0916-5047?
The molecular weight of F0916-5047 is 491.14 g/mol.
Where can I buy F0916-5047?
You can request a quote for F0916-5047 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0916-5047?
Yes, KEHONG BIO provides custom synthesis services for F0916-5047 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.