F0916-4991
TL;DR: F0916-4991 (CAS 451464-73-6) is a chemical compound with molecular formula C32H36N4O5S and molecular weight 588.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[2-[2-(4-ethylanilino)-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]butanamide
Also Known As: F0916-4991, N-(3,4-dimethoxyphenethyl)-4-(2-((2-((4-ethylphenyl)amino)-2-oxoethyl)thio)-4-oxoquinazolin-3(4H)-yl)butanamide, N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[2-({[(4-ethylphenyl)carbamoyl]methyl}sulfanyl)-4-oxo-3,4-dihydroquinazolin-3-yl]butanamide, N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[2-[2-(4-ethylanilino)-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]butanamide
| Molecular Formula | C32H36N4O5S |
|---|---|
| Molecular Weight | 588.24 g/mol |
| LogP | 4.846 |
| Topological Polar Surface Area | 111.55 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 14 |
| Exact Mass | 588.24066 |
| Heavy Atoms | 42 |
| Complexity | 1586.639 |
Chemical Identifiers
| CAS Number | 451464-73-6 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCCC(=O)NCCC4=CC(=C(C=C4)OC)OC |
Product Overview
F0916-4991 (CAS 451464-73-6), with molecular formula C32H36N4O5S and molecular weight 588.24 g/mol. IUPAC: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[2-[2-(4-ethylanilino)-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]butanamide.
Chemical Property Profile of F0916-4991
Property Insights of F0916-4991
The XLogP value of 4.846 indicates that F0916-4991 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.55 Ų falls within the moderate polarity range, balancing permeability and solubility for F0916-4991. Following Lipinski's Rule of Five, F0916-4991 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0916-4991?
The CAS number of F0916-4991 is 451464-73-6.
What is the molecular formula of F0916-4991?
The molecular formula of F0916-4991 is C32H36N4O5S.
What is the molecular weight of F0916-4991?
The molecular weight of F0916-4991 is 588.24 g/mol.
Where can I buy F0916-4991?
You can request a quote for F0916-4991 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0916-4991?
Yes, KEHONG BIO provides custom synthesis services for F0916-4991 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.