![10-butyl-3-methylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione structure](/static/products/5999/59997-16-9.webp)
10-butyl-3-methylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione
TL;DR: 10-butyl-3-methylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione (CAS 59997-16-9) is a chemical compound with molecular formula C16H17N3O2 and molecular weight 283.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-butyl-3-methylpyrimido[4,5-b]quinoline-2,4-dione
Also Known As: 10-butyl-3-methylpyrimido[4,5-b]quinoline-2,4-dione, Pyrimido[4,4(3H,10H)-dione, 10-butyl-3-methyl-, 10-butyl-3-methylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione
| Molecular Formula | C16H17N3O2 |
|---|---|
| Molecular Weight | 283.13 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 53.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 283.13208 |
| Heavy Atoms | 21 |
| Complexity | 524.0 |
Chemical Identifiers
| CAS Number | 59997-16-9 |
|---|---|
| SMILES | CCCCN1C2=CC=CC=C2C=C3C1=NC(=O)N(C3=O)C |
| InChIKey | WZHOKCUFDKOZGY-UHFFFAOYSA-N |
Product Overview
10-butyl-3-methylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione (CAS 59997-16-9), with molecular formula C16H17N3O2 and molecular weight 283.13 g/mol. IUPAC: 10-butyl-3-methylpyrimido[4,5-b]quinoline-2,4-dione.
Chemical Property Profile of 10-butyl-3-methylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione
Property Insights of 10-butyl-3-methylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 10-butyl-3-methylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione. With a topological polar surface area (TPSA) of 53.0 Ų, 10-butyl-3-methylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 10-butyl-3-methylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione has 0 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 10-butyl-3-methylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione?
The CAS number of 10-butyl-3-methylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione is 59997-16-9.
What is the molecular formula of 10-butyl-3-methylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione?
The molecular formula of 10-butyl-3-methylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione is C16H17N3O2.
What is the molecular weight of 10-butyl-3-methylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione?
The molecular weight of 10-butyl-3-methylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione is 283.13 g/mol.
Where can I buy 10-butyl-3-methylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione?
You can request a quote for 10-butyl-3-methylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 10-butyl-3-methylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 10-butyl-3-methylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.