4-Amino-3-(3-chlorophenyl)spiro[4.5]deca-3,6,9-triene-2,8-dione
TL;DR: 4-Amino-3-(3-chlorophenyl)spiro[4.5]deca-3,6,9-triene-2,8-dione (CAS 62234-98-4) is a chemical compound with molecular formula C16H12ClNO2 and molecular weight 285.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-3-(3-chlorophenyl)spiro[4.5]deca-3,6,9-triene-2,8-dione
Also Known As: 4-amino-3-(3-chlorophenyl)spiro[4.5]deca-3,6,9-triene-2,8-dione, 4-amino-3-(3-chlorophenyl)spiro[4.5]deca-3,6,9-triene-2,8-di
| Molecular Formula | C16H12ClNO2 |
|---|---|
| Molecular Weight | 285.06 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 60.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 285.05566 |
| Heavy Atoms | 20 |
| Complexity | 543.0 |
Chemical Identifiers
| CAS Number | 62234-98-4 |
|---|---|
| SMILES | C1C(=O)C(=C(C12C=CC(=O)C=C2)N)C3=CC(=CC=C3)Cl |
| InChIKey | LOUWXZGHPPJCMD-UHFFFAOYSA-N |
Product Overview
4-Amino-3-(3-chlorophenyl)spiro[4.5]deca-3,6,9-triene-2,8-dione (CAS 62234-98-4), with molecular formula C16H12ClNO2 and molecular weight 285.06 g/mol. IUPAC: 4-amino-3-(3-chlorophenyl)spiro[4.5]deca-3,6,9-triene-2,8-dione.
Chemical Property Profile of 4-Amino-3-(3-chlorophenyl)spiro[4.5]deca-3,6,9-triene-2,8-dione
Property Insights of 4-Amino-3-(3-chlorophenyl)spiro[4.5]deca-3,6,9-triene-2,8-dione
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Amino-3-(3-chlorophenyl)spiro[4.5]deca-3,6,9-triene-2,8-dione. The TPSA of 60.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Amino-3-(3-chlorophenyl)spiro[4.5]deca-3,6,9-triene-2,8-dione. Following Lipinski's Rule of Five, 4-Amino-3-(3-chlorophenyl)spiro[4.5]deca-3,6,9-triene-2,8-dione has 1 hydrogen bond donor(s) and 3 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 4-Amino-3-(3-chlorophenyl)spiro[4.5]deca-3,6,9-triene-2,8-dione?
The CAS number of 4-Amino-3-(3-chlorophenyl)spiro[4.5]deca-3,6,9-triene-2,8-dione is 62234-98-4.
What is the molecular formula of 4-Amino-3-(3-chlorophenyl)spiro[4.5]deca-3,6,9-triene-2,8-dione?
The molecular formula of 4-Amino-3-(3-chlorophenyl)spiro[4.5]deca-3,6,9-triene-2,8-dione is C16H12ClNO2.
What is the molecular weight of 4-Amino-3-(3-chlorophenyl)spiro[4.5]deca-3,6,9-triene-2,8-dione?
The molecular weight of 4-Amino-3-(3-chlorophenyl)spiro[4.5]deca-3,6,9-triene-2,8-dione is 285.06 g/mol.
Where can I buy 4-Amino-3-(3-chlorophenyl)spiro[4.5]deca-3,6,9-triene-2,8-dione?
You can request a quote for 4-Amino-3-(3-chlorophenyl)spiro[4.5]deca-3,6,9-triene-2,8-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Amino-3-(3-chlorophenyl)spiro[4.5]deca-3,6,9-triene-2,8-dione?
Yes, KEHONG BIO provides custom synthesis services for 4-Amino-3-(3-chlorophenyl)spiro[4.5]deca-3,6,9-triene-2,8-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.