![methyl 2-amino-4-(6-chloro(2H-benzo[d]1,3-dioxolan-5-yl))-7,7-dimethyl-5-oxo-4 H-6,7,8-trihydrochromene-3-carboxylate structure](/static/products/307/307495-22-3.png)
methyl 2-amino-4-(6-chloro(2H-benzo[d]1,3-dioxolan-5-yl))-7,7-dimethyl-5-oxo-4 H-6,7,8-trihydrochromene-3-carboxylate
TL;DR: methyl 2-amino-4-(6-chloro(2H-benzo[d]1,3-dioxolan-5-yl))-7,7-dimethyl-5-oxo-4 H-6,7,8-trihydrochromene-3-carboxylate (CAS 307495-22-3) is a chemical compound with molecular formula C20H20ClNO6 and molecular weight 405.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-amino-4-(6-chloro-1,3-benzodioxol-5-yl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carboxylate
Also Known As: methyl 2-amino-4-(6-chloro(2H-benzo[d]1,3-dioxolan-5-yl))-7,7-dimethyl-5-oxo-4 H-6,7,8-trihydrochromene-3-carboxylate, methyl 2-amino-4-(6-chloro-1,3-benzodioxol-5-yl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate, methyl 2-amino-4-(6-chloro-1,3-benzodioxol-5-yl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carboxylate, METHYL 2-AMINO-4-(6-CHLORO-2H-1,3-BENZODIOXOL-5-YL)-7,7-DIMETHYL-5-OXO-6,8-DIHYDRO-4H-CHROMENE-3-CARBOXYLATE, methyl 2-amino-4-(6-chlorobenzo[d][1,3]dioxol-5-yl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate
| Molecular Formula | C20H20ClNO6 |
|---|---|
| Molecular Weight | 405.10 g/mol |
| LogP | 3.169 |
| Topological Polar Surface Area | 97.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 405.0979 |
| Heavy Atoms | 28 |
| Complexity | 961.68774 |
Chemical Identifiers
| CAS Number | 307495-22-3 |
|---|---|
| SMILES | CC1(CC2=C(C(C(=C(O2)N)C(=O)OC)C3=CC4=C(C=C3Cl)OCO4)C(=O)C1)C |
Product Overview
methyl 2-amino-4-(6-chloro(2H-benzo[d]1,3-dioxolan-5-yl))-7,7-dimethyl-5-oxo-4 H-6,7,8-trihydrochromene-3-carboxylate (CAS 307495-22-3), with molecular formula C20H20ClNO6 and molecular weight 405.10 g/mol. IUPAC: methyl 2-amino-4-(6-chloro-1,3-benzodioxol-5-yl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carboxylate.
Chemical Property Profile of methyl 2-amino-4-(6-chloro(2H-benzo[d]1,3-dioxolan-5-yl))-7,7-dimethyl-5-oxo-4 H-6,7,8-trihydrochromene-3-carboxylate
Property Insights of methyl 2-amino-4-(6-chloro(2H-benzo[d]1,3-dioxolan-5-yl))-7,7-dimethyl-5-oxo-4 H-6,7,8-trihydrochromene-3-carboxylate
The XLogP value of 3.169 indicates that methyl 2-amino-4-(6-chloro(2H-benzo[d]1,3-dioxolan-5-yl))-7,7-dimethyl-5-oxo-4 H-6,7,8-trihydrochromene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.08 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 2-amino-4-(6-chloro(2H-benzo[d]1,3-dioxolan-5-yl))-7,7-dimethyl-5-oxo-4 H-6,7,8-trihydrochromene-3-carboxylate. Following Lipinski's Rule of Five, methyl 2-amino-4-(6-chloro(2H-benzo[d]1,3-dioxolan-5-yl))-7,7-dimethyl-5-oxo-4 H-6,7,8-trihydrochromene-3-carboxylate has 1 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 methyl 2-amino-4-(6-chloro(2H-benzo[d]1,3-dioxolan-5-yl))-7,7-dimethyl-5-oxo-4 H-6,7,8-trihydrochromene-3-carboxylate?
The CAS number of methyl 2-amino-4-(6-chloro(2H-benzo[d]1,3-dioxolan-5-yl))-7,7-dimethyl-5-oxo-4 H-6,7,8-trihydrochromene-3-carboxylate is 307495-22-3.
What is the molecular formula of methyl 2-amino-4-(6-chloro(2H-benzo[d]1,3-dioxolan-5-yl))-7,7-dimethyl-5-oxo-4 H-6,7,8-trihydrochromene-3-carboxylate?
The molecular formula of methyl 2-amino-4-(6-chloro(2H-benzo[d]1,3-dioxolan-5-yl))-7,7-dimethyl-5-oxo-4 H-6,7,8-trihydrochromene-3-carboxylate is C20H20ClNO6.
What is the molecular weight of methyl 2-amino-4-(6-chloro(2H-benzo[d]1,3-dioxolan-5-yl))-7,7-dimethyl-5-oxo-4 H-6,7,8-trihydrochromene-3-carboxylate?
The molecular weight of methyl 2-amino-4-(6-chloro(2H-benzo[d]1,3-dioxolan-5-yl))-7,7-dimethyl-5-oxo-4 H-6,7,8-trihydrochromene-3-carboxylate is 405.10 g/mol.
Where can I buy methyl 2-amino-4-(6-chloro(2H-benzo[d]1,3-dioxolan-5-yl))-7,7-dimethyl-5-oxo-4 H-6,7,8-trihydrochromene-3-carboxylate?
You can request a quote for methyl 2-amino-4-(6-chloro(2H-benzo[d]1,3-dioxolan-5-yl))-7,7-dimethyl-5-oxo-4 H-6,7,8-trihydrochromene-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 2-amino-4-(6-chloro(2H-benzo[d]1,3-dioxolan-5-yl))-7,7-dimethyl-5-oxo-4 H-6,7,8-trihydrochromene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 2-amino-4-(6-chloro(2H-benzo[d]1,3-dioxolan-5-yl))-7,7-dimethyl-5-oxo-4 H-6,7,8-trihydrochromene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.