ChemDiv1_024574
TL;DR: ChemDiv1_024574 (CAS 374549-55-0) is a chemical compound with molecular formula C26H26N4O2 and molecular weight 426.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
12-[(4-methoxyphenyl)methyl]spiro[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: ChemDiv1_024574, AB00291038-04, AJ-292/40857517, 4-(4-methoxybenzyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one, 4-(4-methoxybenzyl)-6,7-dihydrospiro(benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexane)-5(4H)-one
| Molecular Formula | C26H26N4O2 |
|---|---|
| Molecular Weight | 426.21 g/mol |
| LogP | 4.3729 |
| Topological Polar Surface Area | 61.42 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 426.20557 |
| Heavy Atoms | 32 |
| Complexity | 1361.1035 |
Chemical Identifiers
| CAS Number | 374549-55-0 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CN2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N6C2=NN=C6 |
Product Overview
ChemDiv1_024574 (CAS 374549-55-0), with molecular formula C26H26N4O2 and molecular weight 426.21 g/mol. IUPAC: 12-[(4-methoxyphenyl)methyl]spiro[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 ChemDiv1_024574
Property Insights of ChemDiv1_024574
The XLogP value of 4.3729 indicates that ChemDiv1_024574 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.42 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_024574. Following Lipinski's Rule of Five, ChemDiv1_024574 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 ChemDiv1_024574?
The CAS number of ChemDiv1_024574 is 374549-55-0.
What is the molecular formula of ChemDiv1_024574?
The molecular formula of ChemDiv1_024574 is C26H26N4O2.
What is the molecular weight of ChemDiv1_024574?
The molecular weight of ChemDiv1_024574 is 426.21 g/mol.
Where can I buy ChemDiv1_024574?
You can request a quote for ChemDiv1_024574 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_024574?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_024574 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.