![7-methyl-3-pentyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one structure](/static/products/899/899408-87-8.png)
7-methyl-3-pentyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
TL;DR: 7-methyl-3-pentyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one (CAS 899408-87-8) is a chemical compound with molecular formula C16H19N3O and molecular weight 269.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methyl-3-pentyl-5H-pyrimido[5,4-b]indol-4-one
Also Known As: 7-methyl-3-pentyl-5H-pyrimido[5,4-b]indol-4-one, 7-methyl-3-pentyl-3H-pyrimido[5,4-b]indol-4(5H)-one, 7-methyl-3-pentyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
| Molecular Formula | C16H19N3O |
|---|---|
| Molecular Weight | 269.15 g/mol |
| LogP | 3.37642 |
| Topological Polar Surface Area | 50.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 269.1528 |
| Heavy Atoms | 20 |
| Complexity | 813.5517 |
Chemical Identifiers
| CAS Number | 899408-87-8 |
|---|---|
| SMILES | CCCCCN1C=NC2=C(C1=O)NC3=C2C=CC(=C3)C |
Product Overview
7-methyl-3-pentyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one (CAS 899408-87-8), with molecular formula C16H19N3O and molecular weight 269.15 g/mol. IUPAC: 7-methyl-3-pentyl-5H-pyrimido[5,4-b]indol-4-one.
Chemical Property Profile of 7-methyl-3-pentyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Property Insights of 7-methyl-3-pentyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
The XLogP value of 3.37642 indicates that 7-methyl-3-pentyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.68 Ų, 7-methyl-3-pentyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-methyl-3-pentyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-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 7-methyl-3-pentyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one?
The CAS number of 7-methyl-3-pentyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one is 899408-87-8.
What is the molecular formula of 7-methyl-3-pentyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one?
The molecular formula of 7-methyl-3-pentyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one is C16H19N3O.
What is the molecular weight of 7-methyl-3-pentyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one?
The molecular weight of 7-methyl-3-pentyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one is 269.15 g/mol.
Where can I buy 7-methyl-3-pentyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one?
You can request a quote for 7-methyl-3-pentyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-methyl-3-pentyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one?
Yes, KEHONG BIO provides custom synthesis services for 7-methyl-3-pentyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.