AB01306865-01
TL;DR: AB01306865-01 (CAS 374083-10-0) is a chemical compound with molecular formula C22H26N4OS and molecular weight 394.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
12-ethyl-16-ethylsulfanylspiro[12,14,15,17-tetrazatetracyclo[8.7.0.02,7.013,17]heptadeca-1(10),2,4,6,13,15-hexaene-9,1'-cyclohexane]-11-one
Also Known As: AB01306865-01, 4-ethyl-1-(ethylsulfanyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one, 4-ethyl-1-(ethylthio)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
| Molecular Formula | C22H26N4OS |
|---|---|
| Molecular Weight | 394.18 g/mol |
| LogP | 4.4479 |
| Topological Polar Surface Area | 52.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 394.18274 |
| Heavy Atoms | 28 |
| Complexity | 1107.6576 |
Chemical Identifiers
| CAS Number | 374083-10-0 |
|---|---|
| SMILES | CCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N5C1=NN=C5SCC |
Product Overview
AB01306865-01 (CAS 374083-10-0), with molecular formula C22H26N4OS and molecular weight 394.18 g/mol. IUPAC: 12-ethyl-16-ethylsulfanylspiro[12,14,15,17-tetrazatetracyclo[8.7.0.02,7.013,17]heptadeca-1(10),2,4,6,13,15-hexaene-9,1'-cyclohexane]-11-one.
Chemical Property Profile of AB01306865-01
Property Insights of AB01306865-01
The XLogP value of 4.4479 indicates that AB01306865-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.19 Ų, AB01306865-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB01306865-01 has 0 hydrogen bond donor(s) and 4 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 AB01306865-01?
The CAS number of AB01306865-01 is 374083-10-0.
What is the molecular formula of AB01306865-01?
The molecular formula of AB01306865-01 is C22H26N4OS.
What is the molecular weight of AB01306865-01?
The molecular weight of AB01306865-01 is 394.18 g/mol.
Where can I buy AB01306865-01?
You can request a quote for AB01306865-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01306865-01?
Yes, KEHONG BIO provides custom synthesis services for AB01306865-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.