BAS 00338323
TL;DR: BAS 00338323 (CAS 155473-95-3) is a chemical compound with molecular formula C15H20N4OS and molecular weight 304.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-dimethyl-8-piperazin-1-yl-6-sulfanylidene-4,7-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
Also Known As: BAS 00338323, AE-848/34162002, 3,3-dimethyl-8-(piperazin-1-yl)-6-thioxo-3,4,6,7-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile, 1H-Pyrano[3,4-c]pyridine-5-carbonitrile, 3,4,6,7-tetrahydro-3,3-dimethyl-8-(1-piperazinyl)-6-thioxo-, 3,3-Dimethyl-8-(1-piperazinyl)-6-thioxo-3,4,6,7-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
| Molecular Formula | C15H20N4OS |
|---|---|
| Molecular Weight | 304.14 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 92.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 304.13577 |
| Heavy Atoms | 21 |
| Complexity | 590.0 |
Chemical Identifiers
| CAS Number | 155473-95-3 |
|---|---|
| SMILES | CC1(CC2=C(C(=S)NC(=C2CO1)N3CCNCC3)C#N)C |
| InChIKey | JBYVXYRYVCLESX-UHFFFAOYSA-N |
Product Overview
BAS 00338323 (CAS 155473-95-3), with molecular formula C15H20N4OS and molecular weight 304.14 g/mol. IUPAC: 3,3-dimethyl-8-piperazin-1-yl-6-sulfanylidene-4,7-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile.
Chemical Property Profile of BAS 00338323
Property Insights of BAS 00338323
The XLogP value of -0.2 indicates that BAS 00338323 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 92.4 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00338323. Following Lipinski's Rule of Five, BAS 00338323 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 00338323?
The CAS number of BAS 00338323 is 155473-95-3.
What is the molecular formula of BAS 00338323?
The molecular formula of BAS 00338323 is C15H20N4OS.
What is the molecular weight of BAS 00338323?
The molecular weight of BAS 00338323 is 304.14 g/mol.
Where can I buy BAS 00338323?
You can request a quote for BAS 00338323 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00338323?
Yes, KEHONG BIO provides custom synthesis services for BAS 00338323 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.