BAS 08978485
TL;DR: BAS 08978485 (CAS 708996-75-2) is a chemical compound with molecular formula C26H29N3O3 and molecular weight 431.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2'-amino-6,7',7',9,11,11-hexamethyl-2,5'-dioxospiro[1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-triene-3,4'-6,8-dihydrochromene]-3'-carbonitrile
Also Known As: BAS 08978485, 2-amino-4',4',6',7,7,8'-hexamethyl-2',5-dioxo-5,5',6,6',7,8-hexahydro-4'H-spiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carbonitrile, 2-amino-4',4',6',7,7,8'-hexamethyl-2',5-dioxo-2',4',5,5',6,6',7,8-octahydrospiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carbonitrile
| Molecular Formula | C26H29N3O3 |
|---|---|
| Molecular Weight | 431.22 g/mol |
| LogP | 4.2325 |
| Topological Polar Surface Area | 96.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 431.2209 |
| Heavy Atoms | 32 |
| Complexity | 1227.4392 |
Chemical Identifiers
| CAS Number | 708996-75-2 |
|---|---|
| SMILES | CC1CC(N2C3=C1C=C(C=C3C4(C2=O)C(=C(OC5=C4C(=O)CC(C5)(C)C)N)C#N)C)(C)C |
Product Overview
BAS 08978485 (CAS 708996-75-2), with molecular formula C26H29N3O3 and molecular weight 431.22 g/mol. IUPAC: 2'-amino-6,7',7',9,11,11-hexamethyl-2,5'-dioxospiro[1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-triene-3,4'-6,8-dihydrochromene]-3'-carbonitrile.
Chemical Property Profile of BAS 08978485
Property Insights of BAS 08978485
The XLogP value of 4.2325 indicates that BAS 08978485 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.42 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 08978485. Following Lipinski's Rule of Five, BAS 08978485 has 1 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 08978485?
The CAS number of BAS 08978485 is 708996-75-2.
What is the molecular formula of BAS 08978485?
The molecular formula of BAS 08978485 is C26H29N3O3.
What is the molecular weight of BAS 08978485?
The molecular weight of BAS 08978485 is 431.22 g/mol.
Where can I buy BAS 08978485?
You can request a quote for BAS 08978485 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 08978485?
Yes, KEHONG BIO provides custom synthesis services for BAS 08978485 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.