![5a,6,7,8,9,10-hexahydro-5H-azepino[2,1-b]quinazolin-12-one structure](/static/products/6763/67634-35-9.webp)
5a,6,7,8,9,10-hexahydro-5H-azepino[2,1-b]quinazolin-12-one
TL;DR: 5a,6,7,8,9,10-hexahydro-5H-azepino[2,1-b]quinazolin-12-one (CAS 67634-35-9) is a chemical compound with molecular formula C13H16N2O and molecular weight 216.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5a,6,7,8,9,10-hexahydro-5H-azepino[2,1-b]quinazolin-12-one
Also Known As: 5a,6,7,8,9,10-hexahydroazepino[2,1-b]quinazolin-12(5H)-one, 5a,6,7,8,9,10-hexahydro-5H-azepino[2,1-b]quinazolin-12-one, 2,3-pentamethylene-1,2,3,4-tetrahydro-4-quinazolone, 2,3-pentamethylene-1,2,3,4-tetrahydroquinazolin-4-one, Azepino[2,1-b]quinazolin-12(5H)-one, 5a,6,7,8,9,10-hexahydro-
| Molecular Formula | C13H16N2O |
|---|---|
| Molecular Weight | 216.13 g/mol |
| LogP | 2.4544 |
| Topological Polar Surface Area | 32.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 216.12627 |
| Heavy Atoms | 16 |
| Complexity | 416.14856 |
Chemical Identifiers
| CAS Number | 67634-35-9 |
|---|---|
| SMILES | C1CCC2NC3=CC=CC=C3C(=O)N2CC1 |
Product Overview
5a,6,7,8,9,10-hexahydro-5H-azepino[2,1-b]quinazolin-12-one (CAS 67634-35-9), with molecular formula C13H16N2O and molecular weight 216.13 g/mol. IUPAC: 5a,6,7,8,9,10-hexahydro-5H-azepino[2,1-b]quinazolin-12-one.
Chemical Property Profile of 5a,6,7,8,9,10-hexahydro-5H-azepino[2,1-b]quinazolin-12-one
Property Insights of 5a,6,7,8,9,10-hexahydro-5H-azepino[2,1-b]quinazolin-12-one
The XLogP value of 2.4544 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5a,6,7,8,9,10-hexahydro-5H-azepino[2,1-b]quinazolin-12-one. With a topological polar surface area (TPSA) of 32.34 Ų, 5a,6,7,8,9,10-hexahydro-5H-azepino[2,1-b]quinazolin-12-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5a,6,7,8,9,10-hexahydro-5H-azepino[2,1-b]quinazolin-12-one has 1 hydrogen bond donor(s) and 2 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 5a,6,7,8,9,10-hexahydro-5H-azepino[2,1-b]quinazolin-12-one?
The CAS number of 5a,6,7,8,9,10-hexahydro-5H-azepino[2,1-b]quinazolin-12-one is 67634-35-9.
What is the molecular formula of 5a,6,7,8,9,10-hexahydro-5H-azepino[2,1-b]quinazolin-12-one?
The molecular formula of 5a,6,7,8,9,10-hexahydro-5H-azepino[2,1-b]quinazolin-12-one is C13H16N2O.
What is the molecular weight of 5a,6,7,8,9,10-hexahydro-5H-azepino[2,1-b]quinazolin-12-one?
The molecular weight of 5a,6,7,8,9,10-hexahydro-5H-azepino[2,1-b]quinazolin-12-one is 216.13 g/mol.
Where can I buy 5a,6,7,8,9,10-hexahydro-5H-azepino[2,1-b]quinazolin-12-one?
You can request a quote for 5a,6,7,8,9,10-hexahydro-5H-azepino[2,1-b]quinazolin-12-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5a,6,7,8,9,10-hexahydro-5H-azepino[2,1-b]quinazolin-12-one?
Yes, KEHONG BIO provides custom synthesis services for 5a,6,7,8,9,10-hexahydro-5H-azepino[2,1-b]quinazolin-12-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.