BAS 03604549
TL;DR: BAS 03604549 (CAS 474089-68-4) is a chemical compound with molecular formula C22H28N2O4 and molecular weight 384.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-N-(4-methoxyphenyl)cyclohexane-1-carboxamide
Also Known As: BAS 03604549, 4-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-N-(4-methoxyphenyl)cyclohexane-1-carboxamide, 4-(1,3-Dioxo-octahydro-isoindol-2-yl)-cyclohexanecarboxylic acid (4-methoxy-phenyl)-amide, 4-(1,3-dioxooctahydro-2H-isoindol-2-yl)-N-(4-methoxyphenyl)cyclohexanecarboxamide, Cambridge id 6823064
| Molecular Formula | C22H28N2O4 |
|---|---|
| Molecular Weight | 384.20 g/mol |
| LogP | 3.3677 |
| Topological Polar Surface Area | 75.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 384.2049 |
| Heavy Atoms | 28 |
| Complexity | 728.3052 |
Chemical Identifiers
| CAS Number | 474089-68-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC(=O)C2CCC(CC2)N3C(=O)C4CCCCC4C3=O |
Product Overview
BAS 03604549 (CAS 474089-68-4), with molecular formula C22H28N2O4 and molecular weight 384.20 g/mol. IUPAC: 4-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-N-(4-methoxyphenyl)cyclohexane-1-carboxamide.
Chemical Property Profile of BAS 03604549
Property Insights of BAS 03604549
The XLogP value of 3.3677 indicates that BAS 03604549 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.71 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03604549. Following Lipinski's Rule of Five, BAS 03604549 has 1 hydrogen bond donor(s) and 4 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 03604549?
The CAS number of BAS 03604549 is 474089-68-4.
What is the molecular formula of BAS 03604549?
The molecular formula of BAS 03604549 is C22H28N2O4.
What is the molecular weight of BAS 03604549?
The molecular weight of BAS 03604549 is 384.20 g/mol.
Where can I buy BAS 03604549?
You can request a quote for BAS 03604549 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03604549?
Yes, KEHONG BIO provides custom synthesis services for BAS 03604549 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.