![4-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-5,8-dimethyl-5H-pyrimido[5,4-b]indole structure](/static/products/850/850720-87-5.png)
4-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-5,8-dimethyl-5H-pyrimido[5,4-b]indole
TL;DR: 4-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-5,8-dimethyl-5H-pyrimido[5,4-b]indole (CAS 850720-87-5) is a chemical compound with molecular formula C19H22N4O2 and molecular weight 338.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(5,8-dimethylpyrimido[5,4-b]indol-4-yl)-1,4-dioxa-8-azaspiro[4.5]decane
Also Known As: 4-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-5,8-dimethyl-5H-pyrimido[5,4-b]indole, 8-(5,8-dimethyl-5H-pyrimido[5,4-b]indol-4-yl)-1,4-dioxa-8-azaspiro[4.5]decane, 8-(5,8-dimethylpyrimido[5,4-b]indol-4-yl)-1,4-dioxa-8-azaspiro[4.5]decane
| Molecular Formula | C19H22N4O2 |
|---|---|
| Molecular Weight | 338.17 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 52.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 338.1743 |
| Heavy Atoms | 25 |
| Complexity | 488.0 |
Chemical Identifiers
| CAS Number | 850720-87-5 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N(C3=C2N=CN=C3N4CCC5(CC4)OCCO5)C |
| InChIKey | LTTFFLLPNMRFTG-UHFFFAOYSA-N |
Product Overview
4-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-5,8-dimethyl-5H-pyrimido[5,4-b]indole (CAS 850720-87-5), with molecular formula C19H22N4O2 and molecular weight 338.17 g/mol. IUPAC: 8-(5,8-dimethylpyrimido[5,4-b]indol-4-yl)-1,4-dioxa-8-azaspiro[4.5]decane.
Chemical Property Profile of 4-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-5,8-dimethyl-5H-pyrimido[5,4-b]indole
Property Insights of 4-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-5,8-dimethyl-5H-pyrimido[5,4-b]indole
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-5,8-dimethyl-5H-pyrimido[5,4-b]indole. With a topological polar surface area (TPSA) of 52.4 Ų, 4-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-5,8-dimethyl-5H-pyrimido[5,4-b]indole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-5,8-dimethyl-5H-pyrimido[5,4-b]indole has 0 hydrogen bond donor(s) and 5 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 4-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-5,8-dimethyl-5H-pyrimido[5,4-b]indole?
The CAS number of 4-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-5,8-dimethyl-5H-pyrimido[5,4-b]indole is 850720-87-5.
What is the molecular formula of 4-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-5,8-dimethyl-5H-pyrimido[5,4-b]indole?
The molecular formula of 4-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-5,8-dimethyl-5H-pyrimido[5,4-b]indole is C19H22N4O2.
What is the molecular weight of 4-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-5,8-dimethyl-5H-pyrimido[5,4-b]indole?
The molecular weight of 4-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-5,8-dimethyl-5H-pyrimido[5,4-b]indole is 338.17 g/mol.
Where can I buy 4-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-5,8-dimethyl-5H-pyrimido[5,4-b]indole?
You can request a quote for 4-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-5,8-dimethyl-5H-pyrimido[5,4-b]indole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-5,8-dimethyl-5H-pyrimido[5,4-b]indole?
Yes, KEHONG BIO provides custom synthesis services for 4-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-5,8-dimethyl-5H-pyrimido[5,4-b]indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.