BAS 00861801
TL;DR: BAS 00861801 (CAS 351498-54-9) is a chemical compound with molecular formula C24H24N2O3 and molecular weight 388.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-oxoethyl]-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione
Also Known As: BAS 00861801, 2-[2-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-oxoethyl]hexahydro-1H-isoindole-1,3(2H)-dione, 2-[2-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-oxoethyl]-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione, 2-(2-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-oxoethyl)hexahydro-1H-isoindole-1,3(2H)-dione, 2-(2-(10H,11H-dibenzo[b,f]azepin-5-yl)-2-oxoethyl)-4,5,6,7,3a,7a-hexahydroisoi ndole-1,3-dione
| Molecular Formula | C24H24N2O3 |
|---|---|
| Molecular Weight | 388.18 g/mol |
| LogP | 3.6251 |
| Topological Polar Surface Area | 57.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 388.17868 |
| Heavy Atoms | 29 |
| Complexity | 927.62524 |
Chemical Identifiers
| CAS Number | 351498-54-9 |
|---|---|
| SMILES | C1CCC2C(C1)C(=O)N(C2=O)CC(=O)N3C4=CC=CC=C4CCC5=CC=CC=C53 |
Product Overview
BAS 00861801 (CAS 351498-54-9), with molecular formula C24H24N2O3 and molecular weight 388.18 g/mol. IUPAC: 2-[2-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-oxoethyl]-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione.
Chemical Property Profile of BAS 00861801
Property Insights of BAS 00861801
The XLogP value of 3.6251 indicates that BAS 00861801 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.69 Ų, BAS 00861801 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00861801 has 0 hydrogen bond donor(s) and 3 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 00861801?
The CAS number of BAS 00861801 is 351498-54-9.
What is the molecular formula of BAS 00861801?
The molecular formula of BAS 00861801 is C24H24N2O3.
What is the molecular weight of BAS 00861801?
The molecular weight of BAS 00861801 is 388.18 g/mol.
Where can I buy BAS 00861801?
You can request a quote for BAS 00861801 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00861801?
Yes, KEHONG BIO provides custom synthesis services for BAS 00861801 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.