BAS 00386229
TL;DR: BAS 00386229 (CAS 331665-70-4) is a chemical compound with molecular formula C24H30N2OS and molecular weight 394.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-cyclopentyl-2-ethylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one
Also Known As: BAS 00386229, 3-cyclopentyl-2-ethylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one, 2-(ethylsulfanyl)-3-cyclopentyl-5,6-dihydro-4(3H)-oxospiro(benzo[h]quinazoline-5,1'-cyclohexane), 3-cyclopentyl-2-(ethylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one, 3-cyclopentyl-2-(ethylthio)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
| Molecular Formula | C24H30N2OS |
|---|---|
| Molecular Weight | 394.21 g/mol |
| LogP | 5.8954 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 394.2079 |
| Heavy Atoms | 28 |
| Complexity | 936.1067 |
Chemical Identifiers
| CAS Number | 331665-70-4 |
|---|---|
| SMILES | CCSC1=NC2=C(C(=O)N1C3CCCC3)C4(CCCCC4)CC5=CC=CC=C52 |
Product Overview
BAS 00386229 (CAS 331665-70-4), with molecular formula C24H30N2OS and molecular weight 394.21 g/mol. IUPAC: 3-cyclopentyl-2-ethylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one.
Chemical Property Profile of BAS 00386229
Property Insights of BAS 00386229
The XLogP value of 5.8954 indicates that BAS 00386229 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.89 Ų, BAS 00386229 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00386229 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00386229?
The CAS number of BAS 00386229 is 331665-70-4.
What is the molecular formula of BAS 00386229?
The molecular formula of BAS 00386229 is C24H30N2OS.
What is the molecular weight of BAS 00386229?
The molecular weight of BAS 00386229 is 394.21 g/mol.
Where can I buy BAS 00386229?
You can request a quote for BAS 00386229 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00386229?
Yes, KEHONG BIO provides custom synthesis services for BAS 00386229 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.