AL-281/11337025
TL;DR: AL-281/11337025 (CAS 327167-36-2) is a chemical compound with molecular formula C31H33ClN2O2S and molecular weight 532.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-3-(cyclopentylmethyl)spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one
Also Known As: AL-281/11337025, J2.392.682B, 2-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-3-(cyclopentylmethyl)spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one, 2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3-(cyclopentylmethyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one, 2-{[2-(4-CHLOROPHENYL)-2-OXOETHYL]SULFANYL}-3-(CYCLOPENTYLMETHYL)-4,6-DIHYDRO-3H-SPIRO[BENZO[H]QUINAZOLINE-5,1'-CYCLOHEXAN]-4-ONE
| Molecular Formula | C31H33ClN2O2S |
|---|---|
| Molecular Weight | 532.20 g/mol |
| LogP | 7.4869 |
| Topological Polar Surface Area | 51.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 532.1951 |
| Heavy Atoms | 37 |
| Complexity | 1368.9457 |
Chemical Identifiers
| CAS Number | 327167-36-2 |
|---|---|
| SMILES | C1CCC2(CC1)CC3=CC=CC=C3C4=C2C(=O)N(C(=N4)SCC(=O)C5=CC=C(C=C5)Cl)CC6CCCC6 |
Product Overview
AL-281/11337025 (CAS 327167-36-2), with molecular formula C31H33ClN2O2S and molecular weight 532.20 g/mol. IUPAC: 2-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-3-(cyclopentylmethyl)spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one.
Chemical Property Profile of AL-281/11337025
Property Insights of AL-281/11337025
The XLogP value of 7.4869 indicates that AL-281/11337025 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.96 Ų, AL-281/11337025 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AL-281/11337025 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AL-281/11337025?
The CAS number of AL-281/11337025 is 327167-36-2.
What is the molecular formula of AL-281/11337025?
The molecular formula of AL-281/11337025 is C31H33ClN2O2S.
What is the molecular weight of AL-281/11337025?
The molecular weight of AL-281/11337025 is 532.20 g/mol.
Where can I buy AL-281/11337025?
You can request a quote for AL-281/11337025 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AL-281/11337025?
Yes, KEHONG BIO provides custom synthesis services for AL-281/11337025 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.