AN-979/15447102
TL;DR: AN-979/15447102 (CAS 405901-67-9) is a chemical compound with molecular formula C21H20N2O6 and molecular weight 396.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-hydroxy-4-methoxyphenyl)-1,3-dioxo-2-(oxolan-2-ylmethyl)isoindole-5-carboxamide
Also Known As: AN-979/15447102, N-(3-hydroxy-4-methoxyphenyl)-1,3-dioxo-2-(oxolan-2-ylmethyl)isoindole-5-carboxamide, N-(3-hydroxy-4-methoxyphenyl)-1,3-dioxo-2-(tetrahydrofuran-2-ylmethyl)-2,3-dihydro-1H-isoindole-5-carboxamide, N-(3-hydroxy-4-methoxyphenyl)-1,3-dioxo-2-((tetrahydrofuran-2-yl)methyl)isoindoline-5-carboxamide, N-[3-hydroxy-4-(methyloxy)phenyl]-1,3-dioxo-2-(tetrahydrofuran-2-ylmethyl)-2,3-dihydro-1H-isoindole-5-carboxamide
| Molecular Formula | C21H20N2O6 |
|---|---|
| Molecular Weight | 396.13 g/mol |
| LogP | 2.4281 |
| Topological Polar Surface Area | 105.17 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 396.13214 |
| Heavy Atoms | 29 |
| Complexity | 996.661 |
Chemical Identifiers
| CAS Number | 405901-67-9 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC4CCCO4)O |
Product Overview
AN-979/15447102 (CAS 405901-67-9), with molecular formula C21H20N2O6 and molecular weight 396.13 g/mol. IUPAC: N-(3-hydroxy-4-methoxyphenyl)-1,3-dioxo-2-(oxolan-2-ylmethyl)isoindole-5-carboxamide.
Chemical Property Profile of AN-979/15447102
Property Insights of AN-979/15447102
The XLogP value of 2.4281 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AN-979/15447102. The TPSA of 105.17 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-979/15447102. Following Lipinski's Rule of Five, AN-979/15447102 has 2 hydrogen bond donor(s) and 6 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 AN-979/15447102?
The CAS number of AN-979/15447102 is 405901-67-9.
What is the molecular formula of AN-979/15447102?
The molecular formula of AN-979/15447102 is C21H20N2O6.
What is the molecular weight of AN-979/15447102?
The molecular weight of AN-979/15447102 is 396.13 g/mol.
Where can I buy AN-979/15447102?
You can request a quote for AN-979/15447102 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-979/15447102?
Yes, KEHONG BIO provides custom synthesis services for AN-979/15447102 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.