BAS 02508987
TL;DR: BAS 02508987 (CAS 516456-20-5) is a chemical compound with molecular formula C26H24N2O3 and molecular weight 412.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(furan-2-yl)-9-phenyl-5-propanoyl-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one
Also Known As: BAS 02508987, 6-(furan-2-yl)-9-phenyl-5-propanoyl-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one, 1-[11-(furan-2-yl)-1-hydroxy-3-phenyl-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]propan-1-one, 11-(2-furyl)-3-phenyl-10-propionyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one, 1-(11-(furan-2-yl)-1-hydroxy-3-phenyl-3,4-dihydro-2H-dibenzo[b,e][1,4]diazepin-10(11H)-yl)propan-1-one
| Molecular Formula | C26H24N2O3 |
|---|---|
| Molecular Weight | 412.18 g/mol |
| LogP | 5.5902 |
| Topological Polar Surface Area | 62.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 412.17868 |
| Heavy Atoms | 31 |
| Complexity | 1148.4148 |
Chemical Identifiers
| CAS Number | 516456-20-5 |
|---|---|
| SMILES | CCC(=O)N1C(C2=C(CC(CC2=O)C3=CC=CC=C3)NC4=CC=CC=C41)C5=CC=CO5 |
Product Overview
BAS 02508987 (CAS 516456-20-5), with molecular formula C26H24N2O3 and molecular weight 412.18 g/mol. IUPAC: 6-(furan-2-yl)-9-phenyl-5-propanoyl-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one.
Chemical Property Profile of BAS 02508987
Property Insights of BAS 02508987
The XLogP value of 5.5902 indicates that BAS 02508987 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.55 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02508987. Following Lipinski's Rule of Five, BAS 02508987 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 02508987?
The CAS number of BAS 02508987 is 516456-20-5.
What is the molecular formula of BAS 02508987?
The molecular formula of BAS 02508987 is C26H24N2O3.
What is the molecular weight of BAS 02508987?
The molecular weight of BAS 02508987 is 412.18 g/mol.
Where can I buy BAS 02508987?
You can request a quote for BAS 02508987 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02508987?
Yes, KEHONG BIO provides custom synthesis services for BAS 02508987 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.