ChemDiv1_003648
TL;DR: ChemDiv1_003648 (CAS 309927-40-0) is a chemical compound with molecular formula C26H25ClN2O4 and molecular weight 464.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-4-[3-[(4-chlorophenoxy)methyl]-4-methoxyphenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile
Also Known As: ChemDiv1_003648, AM-807/13614210, 2-amino-4-{3-[(4-chlorophenoxy)methyl]-4-methoxyphenyl}-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile, 2-amino-4-[3-[(4-chlorophenoxy)methyl]-4-methoxyphenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile, 2-amino-4-{3-[(4-chlorophenoxy)methyl]-4-methoxyphenyl}-7,7-dimethyl-5-oxo-4H- 6,7,8-trihydrochromene-3-carbonitrile
| Molecular Formula | C26H25ClN2O4 |
|---|---|
| Molecular Weight | 464.15 g/mol |
| LogP | 5.37848 |
| Topological Polar Surface Area | 94.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 464.1503 |
| Heavy Atoms | 33 |
| Complexity | 1205.788 |
Chemical Identifiers
| CAS Number | 309927-40-0 |
|---|---|
| SMILES | CC1(CC2=C(C(C(=C(O2)N)C#N)C3=CC(=C(C=C3)OC)COC4=CC=C(C=C4)Cl)C(=O)C1)C |
Product Overview
ChemDiv1_003648 (CAS 309927-40-0), with molecular formula C26H25ClN2O4 and molecular weight 464.15 g/mol. IUPAC: 2-amino-4-[3-[(4-chlorophenoxy)methyl]-4-methoxyphenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile.
Chemical Property Profile of ChemDiv1_003648
Property Insights of ChemDiv1_003648
The XLogP value of 5.37848 indicates that ChemDiv1_003648 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.57 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_003648. Following Lipinski's Rule of Five, ChemDiv1_003648 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_003648?
The CAS number of ChemDiv1_003648 is 309927-40-0.
What is the molecular formula of ChemDiv1_003648?
The molecular formula of ChemDiv1_003648 is C26H25ClN2O4.
What is the molecular weight of ChemDiv1_003648?
The molecular weight of ChemDiv1_003648 is 464.15 g/mol.
Where can I buy ChemDiv1_003648?
You can request a quote for ChemDiv1_003648 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_003648?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_003648 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.