BAS 07417040
TL;DR: BAS 07417040 (CAS 340812-53-5) is a chemical compound with molecular formula C16H21N5O2 and molecular weight 315.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1'-acetyl-6-amino-3-propylspiro[2H-pyrano[2,3-c]pyrazole-4,4'-piperidine]-5-carbonitrile
Also Known As: BAS 07417040, 1'-acetyl-6-amino-5-cyano-3-propyl-2,4-dihydrospiro[pyrano[2,3-c]pyrazole-4,4'-piperidine], J1.736.173B, AM-807/12739106, 1'-acetyl-6-amino-3-propylspiro[2H-pyrano[2,3-c]pyrazole-4,4'-piperidine]-5-carbonitrile
| Molecular Formula | C16H21N5O2 |
|---|---|
| Molecular Weight | 315.17 g/mol |
| LogP | 1.32858 |
| Topological Polar Surface Area | 108.03 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 315.16953 |
| Heavy Atoms | 23 |
| Complexity | 704.5431 |
Chemical Identifiers
| CAS Number | 340812-53-5 |
|---|---|
| SMILES | CCCC1=C2C(=NN1)OC(=C(C23CCN(CC3)C(=O)C)C#N)N |
Product Overview
BAS 07417040 (CAS 340812-53-5), with molecular formula C16H21N5O2 and molecular weight 315.17 g/mol. IUPAC: 1'-acetyl-6-amino-3-propylspiro[2H-pyrano[2,3-c]pyrazole-4,4'-piperidine]-5-carbonitrile.
Chemical Property Profile of BAS 07417040
Property Insights of BAS 07417040
The XLogP value of 1.32858 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 07417040. The TPSA of 108.03 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 07417040. Following Lipinski's Rule of Five, BAS 07417040 has 2 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 07417040?
The CAS number of BAS 07417040 is 340812-53-5.
What is the molecular formula of BAS 07417040?
The molecular formula of BAS 07417040 is C16H21N5O2.
What is the molecular weight of BAS 07417040?
The molecular weight of BAS 07417040 is 315.17 g/mol.
Where can I buy BAS 07417040?
You can request a quote for BAS 07417040 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 07417040?
Yes, KEHONG BIO provides custom synthesis services for BAS 07417040 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.