A3601/0152580
TL;DR: A3601/0152580 (CAS 1005122-79-1) is a chemical compound with molecular formula C19H24O5 and molecular weight 332.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[1-(2,4-dimethylphenyl)-1-oxopropan-2-yl]-5,5-dimethyl-2-oxooxolane-3-carboxylate
Also Known As: A3601/0152580, methyl 4-[2-(2,4-dimethylphenyl)-1-methyl-2-oxoethyl]-5,5-dimethyl-2-oxotetrahydro-3-furancarboxylate, methyl 4-(1-(2,4-dimethylphenyl)-1-oxopropan-2-yl)-5,5-dimethyl-2-oxotetrahydrofuran-3-carboxylate, methyl 4-[1-(2,4-dimethylphenyl)-1-oxopropan-2-yl]-5,5-dimethyl-2-oxooxolane-3-carboxylate, methyl 4-[1-(2,4-dimethylphenyl)-1-oxopropan-2-yl]-5,5-dimethyl-2-oxotetrahydrofuran-3-carboxylate
| Molecular Formula | C19H24O5 |
|---|---|
| Molecular Weight | 332.16 g/mol |
| LogP | 2.86304 |
| Topological Polar Surface Area | 69.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 332.16238 |
| Heavy Atoms | 24 |
| Complexity | 688.9976 |
Chemical Identifiers
| CAS Number | 1005122-79-1 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C(=O)C(C)C2C(C(=O)OC2(C)C)C(=O)OC)C |
Product Overview
A3601/0152580 (CAS 1005122-79-1), with molecular formula C19H24O5 and molecular weight 332.16 g/mol. IUPAC: methyl 4-[1-(2,4-dimethylphenyl)-1-oxopropan-2-yl]-5,5-dimethyl-2-oxooxolane-3-carboxylate.
Chemical Property Profile of A3601/0152580
Property Insights of A3601/0152580
The XLogP value of 2.86304 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A3601/0152580. The TPSA of 69.67 Ų falls within the moderate polarity range, balancing permeability and solubility for A3601/0152580. Following Lipinski's Rule of Five, A3601/0152580 has 0 hydrogen bond donor(s) and 5 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 A3601/0152580?
The CAS number of A3601/0152580 is 1005122-79-1.
What is the molecular formula of A3601/0152580?
The molecular formula of A3601/0152580 is C19H24O5.
What is the molecular weight of A3601/0152580?
The molecular weight of A3601/0152580 is 332.16 g/mol.
Where can I buy A3601/0152580?
You can request a quote for A3601/0152580 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3601/0152580?
Yes, KEHONG BIO provides custom synthesis services for A3601/0152580 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.