ChemDiv3_003083
TL;DR: ChemDiv3_003083 (CAS 328071-41-6) is a chemical compound with molecular formula C20H24N2OS and molecular weight 340.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethyl-2-ethylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one
Also Known As: ChemDiv3_003083, BAS 01322114, AJ-292/12783023, BRD-K34611232-001-01-7, 3-ethyl-2-(ethylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
| Molecular Formula | C20H24N2OS |
|---|---|
| Molecular Weight | 340.16 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 58.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 340.16095 |
| Heavy Atoms | 24 |
| Complexity | 588.0 |
Chemical Identifiers
| CAS Number | 328071-41-6 |
|---|---|
| SMILES | CCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCC4)N=C1SCC |
| InChIKey | BUEZSTLUXDHGFB-UHFFFAOYSA-N |
Product Overview
ChemDiv3_003083 (CAS 328071-41-6), with molecular formula C20H24N2OS and molecular weight 340.16 g/mol. IUPAC: 3-ethyl-2-ethylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one.
Chemical Property Profile of ChemDiv3_003083
Property Insights of ChemDiv3_003083
The XLogP value of 4.8 indicates that ChemDiv3_003083 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.0 Ų, ChemDiv3_003083 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv3_003083 has 0 hydrogen bond donor(s) and 3 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 ChemDiv3_003083?
The CAS number of ChemDiv3_003083 is 328071-41-6.
What is the molecular formula of ChemDiv3_003083?
The molecular formula of ChemDiv3_003083 is C20H24N2OS.
What is the molecular weight of ChemDiv3_003083?
The molecular weight of ChemDiv3_003083 is 340.16 g/mol.
Where can I buy ChemDiv3_003083?
You can request a quote for ChemDiv3_003083 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_003083?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_003083 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.