Spiroquinazoline
TL;DR: Spiroquinazoline (CAS 157075-58-6) is a chemical compound with molecular formula C23H19N5O3 and molecular weight 413.1488 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
12-methylspiro[2,10,13-triazatetracyclo[10.2.2.02,11.04,9]hexadeca-4,6,8,10-tetraene-16,4'-3,3a-dihydro-2H-imidazo[1,2-a]indole]-1',3,14-trione
Also Known As: Spiroquinazoline, J3.180.071D, 12-Methylspiro[2,10,13-triazatetracyclo[10.2.2.02,11.04,9]hexadeca-4,6,8,10-tetraene-16,4'-3,3a-dihydro-2H-imidazo[1,2-a]indole]-1',3,14-trione, (1R-(1alpha,4alpha,13R*(S*)))-1',9'a-Dihydro-1-methylspiro(1,4-ethano-2H-pyrazino(2,1-b)quinazoline-13,9'-(9H)imidazo(1,2-a)indole)-3,3',6(1H,2'H,4H)-trione, 1',9'a-Dihydro-1-methylspiro(1,4-ethano-2H-pyrazino(2,1-b)quinazoline-13,9'-(9H)imidazo(1,2-a)indole)-3,3',6(1H,2'H,4H)-trione (1R-(1alpha,4alpha,13R*(S*)))-
Technical Specifications
| Molecular Formula | C23H19N5O3 |
| Molecular Weight | 413.1488 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 94.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 413.1488 Da |
| Heavy Atoms | 31 |
| Complexity | 934.0 |
| SMILES | CC12C3=NC4=CC=CC=C4C(=O)N3C(CC15C6NCC(=O)N6C7=CC=CC=C57)C(=O)N2 |
| InChIKey | SIIMITFGYHVBGG-UHFFFAOYSA-N |
Chemical Property Profile of Spiroquinazoline
Property Insights of Spiroquinazoline
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Spiroquinazoline. The TPSA of 94.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Spiroquinazoline. Following Lipinski's Rule of Five, Spiroquinazoline has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Spiroquinazoline?
The CAS number of Spiroquinazoline is 157075-58-6.
What is the molecular formula of Spiroquinazoline?
The molecular formula of Spiroquinazoline is C23H19N5O3.
What is the molecular weight of Spiroquinazoline?
The molecular weight of Spiroquinazoline is 413.1488 g/mol.
Where can I buy Spiroquinazoline?
You can request a quote for Spiroquinazoline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Spiroquinazoline?
Yes, CoreyChem provides custom synthesis services for Spiroquinazoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.