ChemDiv1_003730
TL;DR: ChemDiv1_003730 (CAS 309927-02-4) is a chemical compound with molecular formula C21H23N3O5 and molecular weight 397.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(2-amino-3-cyano-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromen-4-yl)-2-methoxyphenoxy]acetamide
Also Known As: ChemDiv1_003730, BAS 07416713, AM-807/12427141, 2-[4-(2-amino-3-cyano-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromen-4-yl)-2-methoxyphenoxy]acetamide, 2-(4-(2-amino-3-cyano-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromen-4-yl)-2-methoxyphenoxy)acetamide
| Molecular Formula | C21H23N3O5 |
|---|---|
| Molecular Weight | 397.16 g/mol |
| LogP | 2.01018 |
| Topological Polar Surface Area | 137.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 397.16376 |
| Heavy Atoms | 29 |
| Complexity | 984.521 |
Chemical Identifiers
| CAS Number | 309927-02-4 |
|---|---|
| SMILES | CC1(CC2=C(C(C(=C(O2)N)C#N)C3=CC(=C(C=C3)OCC(=O)N)OC)C(=O)C1)C |
Product Overview
ChemDiv1_003730 (CAS 309927-02-4), with molecular formula C21H23N3O5 and molecular weight 397.16 g/mol. IUPAC: 2-[4-(2-amino-3-cyano-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromen-4-yl)-2-methoxyphenoxy]acetamide.
Chemical Property Profile of ChemDiv1_003730
Property Insights of ChemDiv1_003730
The XLogP value of 2.01018 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv1_003730. The TPSA of 137.66 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_003730. Following Lipinski's Rule of Five, ChemDiv1_003730 has 2 hydrogen bond donor(s) and 7 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 ChemDiv1_003730?
The CAS number of ChemDiv1_003730 is 309927-02-4.
What is the molecular formula of ChemDiv1_003730?
The molecular formula of ChemDiv1_003730 is C21H23N3O5.
What is the molecular weight of ChemDiv1_003730?
The molecular weight of ChemDiv1_003730 is 397.16 g/mol.
Where can I buy ChemDiv1_003730?
You can request a quote for ChemDiv1_003730 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_003730?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_003730 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.