BAS 09876376
TL;DR: BAS 09876376 (CAS 876717-84-9) is a chemical compound with molecular formula C18H15N3O3 and molecular weight 321.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2'-amino-1-methyl-2,4-dioxospiro[6,7-dihydro-5H-indole-3,4'-chromene]-3'-carbonitrile
Also Known As: BAS 09876376, 2'-amino-1-methyl-2,4-dioxospiro[6,7-dihydro-5H-indole-3,4'-chromene]-3'-carbonitrile, 2-Amino-1',2',4',5',6',7'-hexahydro-1'-methyl-2',4'-dioxospiro[4H-1-benzopyran-4,3'-[3H]indole]-3-carbonitrile, 2-Amino-1a(2),2a(2),4a(2),5a(2),6a(2),7a(2)-hexahydro-1a(2)-methyl-2a(2),4a(2)-dioxospiro[4H-1-benzopyran-4,3a(2)-[3H]indole]-3-carbonitrile
| Molecular Formula | C18H15N3O3 |
|---|---|
| Molecular Weight | 321.11 g/mol |
| LogP | 1.48978 |
| Topological Polar Surface Area | 96.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 321.11133 |
| Heavy Atoms | 24 |
| Complexity | 906.3292 |
Chemical Identifiers
| CAS Number | 876717-84-9 |
|---|---|
| SMILES | CN1C2=C(C(=O)CCC2)C3(C1=O)C4=CC=CC=C4OC(=C3C#N)N |
Product Overview
BAS 09876376 (CAS 876717-84-9), with molecular formula C18H15N3O3 and molecular weight 321.11 g/mol. IUPAC: 2'-amino-1-methyl-2,4-dioxospiro[6,7-dihydro-5H-indole-3,4'-chromene]-3'-carbonitrile.
Chemical Property Profile of BAS 09876376
Property Insights of BAS 09876376
The XLogP value of 1.48978 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 09876376. The TPSA of 96.42 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 09876376. Following Lipinski's Rule of Five, BAS 09876376 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 09876376?
The CAS number of BAS 09876376 is 876717-84-9.
What is the molecular formula of BAS 09876376?
The molecular formula of BAS 09876376 is C18H15N3O3.
What is the molecular weight of BAS 09876376?
The molecular weight of BAS 09876376 is 321.11 g/mol.
Where can I buy BAS 09876376?
You can request a quote for BAS 09876376 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 09876376?
Yes, KEHONG BIO provides custom synthesis services for BAS 09876376 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.