BAS 00818156
TL;DR: BAS 00818156 (CAS 438462-01-2) is a chemical compound with molecular formula C23H25NO5 and molecular weight 395.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-methylphenyl)-2-oxoethyl] 2-(3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl)-3-methylbutanoate
Also Known As: BAS 00818156, 2-(4-methylphenyl)-2-oxoethyl 2-(3,5-dioxo-4-azatricyclo[5.2.1.0~2,6~]dec-8-en-4-yl)-3-methylbutanoate, 2-(4-methylphenyl)-2-oxoethyl 2-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)-3-methylbutanoate, [2-(4-methylphenyl)-2-oxoethyl] 2-(3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl)-3-methylbutanoate, 2-(4-methylphenyl)-2-oxoethyl 2-(3,5-dioxo-4-azatricyclo[5.2.1.0<2,6>]dec-8-en -4-yl)-3-methylbutanoate
| Molecular Formula | C23H25NO5 |
|---|---|
| Molecular Weight | 395.17 g/mol |
| LogP | 2.55262 |
| Topological Polar Surface Area | 80.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 395.17328 |
| Heavy Atoms | 29 |
| Complexity | 870.3482 |
Chemical Identifiers
| CAS Number | 438462-01-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)COC(=O)C(C(C)C)N2C(=O)C3C4CC(C3C2=O)C=C4 |
Product Overview
BAS 00818156 (CAS 438462-01-2), with molecular formula C23H25NO5 and molecular weight 395.17 g/mol. IUPAC: [2-(4-methylphenyl)-2-oxoethyl] 2-(3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl)-3-methylbutanoate.
Chemical Property Profile of BAS 00818156
Property Insights of BAS 00818156
The XLogP value of 2.55262 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00818156. The TPSA of 80.75 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00818156. Following Lipinski's Rule of Five, BAS 00818156 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 BAS 00818156?
The CAS number of BAS 00818156 is 438462-01-2.
What is the molecular formula of BAS 00818156?
The molecular formula of BAS 00818156 is C23H25NO5.
What is the molecular weight of BAS 00818156?
The molecular weight of BAS 00818156 is 395.17 g/mol.
Where can I buy BAS 00818156?
You can request a quote for BAS 00818156 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00818156?
Yes, KEHONG BIO provides custom synthesis services for BAS 00818156 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.