F0916-4989
TL;DR: F0916-4989 (CAS 451464-71-4) is a chemical compound with molecular formula C34H40N4O7S and molecular weight 648.26 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-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]butanamide
Also Known As: F0916-4989, N-(3,4-dimethoxyphenethyl)-4-(2-((2-((3,4-dimethoxyphenethyl)amino)-2-oxoethyl)thio)-4-oxoquinazolin-3(4H)-yl)butanamide, N-[2-(3,4-dimethoxyphenyl)ethyl]-4-{2-[({[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}methyl)sulfanyl]-4-oxo-3,4-dihydroquinazolin-3-yl}butanamide, N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[2-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]butanamide
| Molecular Formula | C34H40N4O7S |
|---|---|
| Molecular Weight | 648.26 g/mol |
| LogP | 4.021 |
| Topological Polar Surface Area | 130.01 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 17 |
| Exact Mass | 648.2618 |
| Heavy Atoms | 46 |
| Complexity | 1709.2222 |
Chemical Identifiers
| CAS Number | 451464-71-4 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCNC(=O)CCCN2C(=O)C3=CC=CC=C3N=C2SCC(=O)NCCC4=CC(=C(C=C4)OC)OC)OC |
Product Overview
F0916-4989 (CAS 451464-71-4), with molecular formula C34H40N4O7S and molecular weight 648.26 g/mol. IUPAC: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[2-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]butanamide.
Chemical Property Profile of F0916-4989
Property Insights of F0916-4989
The XLogP value of 4.021 indicates that F0916-4989 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 130.01 Ų falls within the moderate polarity range, balancing permeability and solubility for F0916-4989. Following Lipinski's Rule of Five, F0916-4989 has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0916-4989?
The CAS number of F0916-4989 is 451464-71-4.
What is the molecular formula of F0916-4989?
The molecular formula of F0916-4989 is C34H40N4O7S.
What is the molecular weight of F0916-4989?
The molecular weight of F0916-4989 is 648.26 g/mol.
Where can I buy F0916-4989?
You can request a quote for F0916-4989 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0916-4989?
Yes, KEHONG BIO provides custom synthesis services for F0916-4989 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.