BAS 04796055
TL;DR: BAS 04796055 (CAS 200276-48-8) is a chemical compound with molecular formula C16H20N2O2 and molecular weight 272.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-7,7-dimethyl-5-oxospiro[6,8-dihydrochromene-4,1'-cyclopentane]-3-carbonitrile
Also Known As: BAS 04796055, AB00075371-01, AE-848/08322047, 2-amino-7,7-dimethyl-5-oxospiro[6,8-dihydrochromene-4,1'-cyclopentane]-3-carbonitrile, 2-amino-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydrospiro[chromene-4,1'-cyclopentane]-3-carbonitrile
| Molecular Formula | C16H20N2O2 |
|---|---|
| Molecular Weight | 272.15 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 76.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 272.15247 |
| Heavy Atoms | 20 |
| Complexity | 595.0 |
Chemical Identifiers
| CAS Number | 200276-48-8 |
|---|---|
| SMILES | CC1(CC2=C(C(=O)C1)C3(CCCC3)C(=C(O2)N)C#N)C |
| InChIKey | QQJVULBHWVKADA-UHFFFAOYSA-N |
Product Overview
BAS 04796055 (CAS 200276-48-8), with molecular formula C16H20N2O2 and molecular weight 272.15 g/mol. IUPAC: 2-amino-7,7-dimethyl-5-oxospiro[6,8-dihydrochromene-4,1'-cyclopentane]-3-carbonitrile.
Chemical Property Profile of BAS 04796055
Property Insights of BAS 04796055
The XLogP value of 3.1 indicates that BAS 04796055 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.1 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 04796055. Following Lipinski's Rule of Five, BAS 04796055 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 04796055?
The CAS number of BAS 04796055 is 200276-48-8.
What is the molecular formula of BAS 04796055?
The molecular formula of BAS 04796055 is C16H20N2O2.
What is the molecular weight of BAS 04796055?
The molecular weight of BAS 04796055 is 272.15 g/mol.
Where can I buy BAS 04796055?
You can request a quote for BAS 04796055 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04796055?
Yes, KEHONG BIO provides custom synthesis services for BAS 04796055 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.