ChemDiv1_003050
TL;DR: ChemDiv1_003050 (CAS 295779-38-3) is a chemical compound with molecular formula C19H25N3O2S and molecular weight 359.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-dimethyl-6-(2-methylprop-2-enylsulfanyl)-8-morpholin-4-yl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile
Also Known As: ChemDiv1_003050, BAS 01076553, 3,3-dimethyl-6-[(2-methylprop-2-en-1-yl)sulfanyl]-8-(morpholin-4-yl)-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile, 3,3-dimethyl-6-((2-methylallyl)thio)-8-morpholino-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile, 3,3-dimethyl-6-(2-methylprop-2-enylsulfanyl)-8-morpholin-4-yl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile
| Molecular Formula | C19H25N3O2S |
|---|---|
| Molecular Weight | 359.17 g/mol |
| LogP | 3.30938 |
| Topological Polar Surface Area | 58.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 359.16675 |
| Heavy Atoms | 25 |
| Complexity | 718.35986 |
Chemical Identifiers
| CAS Number | 295779-38-3 |
|---|---|
| SMILES | CC(=C)CSC1=C(C2=C(COC(C2)(C)C)C(=N1)N3CCOCC3)C#N |
Product Overview
ChemDiv1_003050 (CAS 295779-38-3), with molecular formula C19H25N3O2S and molecular weight 359.17 g/mol. IUPAC: 3,3-dimethyl-6-(2-methylprop-2-enylsulfanyl)-8-morpholin-4-yl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile.
Chemical Property Profile of ChemDiv1_003050
Property Insights of ChemDiv1_003050
The XLogP value of 3.30938 indicates that ChemDiv1_003050 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.38 Ų, ChemDiv1_003050 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_003050 has 0 hydrogen bond donor(s) and 6 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 ChemDiv1_003050?
The CAS number of ChemDiv1_003050 is 295779-38-3.
What is the molecular formula of ChemDiv1_003050?
The molecular formula of ChemDiv1_003050 is C19H25N3O2S.
What is the molecular weight of ChemDiv1_003050?
The molecular weight of ChemDiv1_003050 is 359.17 g/mol.
Where can I buy ChemDiv1_003050?
You can request a quote for ChemDiv1_003050 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_003050?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_003050 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.