![9-chloro-3-(2-methoxyethyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one structure](/static/products/862/862209-48-1.png)
9-chloro-3-(2-methoxyethyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
TL;DR: 9-chloro-3-(2-methoxyethyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one (CAS 862209-48-1) is a chemical compound with molecular formula C13H12ClN3O2 and molecular weight 277.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-chloro-3-(2-methoxyethyl)-5H-pyrimido[5,4-b]indol-4-one
Also Known As: 9-chloro-3-(2-methoxyethyl)-5H-pyrimido[5,4-b]indol-4-one, 9-chloro-3-(2-methoxyethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one, 9-chloro-3-(2-methoxyethyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
| Molecular Formula | C13H12ClN3O2 |
|---|---|
| Molecular Weight | 277.06 g/mol |
| LogP | 2.1776 |
| Topological Polar Surface Area | 59.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 277.0618 |
| Heavy Atoms | 19 |
| Complexity | 806.6 |
Chemical Identifiers
| CAS Number | 862209-48-1 |
|---|---|
| SMILES | COCCN1C=NC2=C(C1=O)NC3=C2C(=CC=C3)Cl |
Product Overview
9-chloro-3-(2-methoxyethyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one (CAS 862209-48-1), with molecular formula C13H12ClN3O2 and molecular weight 277.06 g/mol. IUPAC: 9-chloro-3-(2-methoxyethyl)-5H-pyrimido[5,4-b]indol-4-one.
Chemical Property Profile of 9-chloro-3-(2-methoxyethyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Property Insights of 9-chloro-3-(2-methoxyethyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
The XLogP value of 2.1776 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9-chloro-3-(2-methoxyethyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one. With a topological polar surface area (TPSA) of 59.91 Ų, 9-chloro-3-(2-methoxyethyl)-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, 9-chloro-3-(2-methoxyethyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one has 1 hydrogen bond donor(s) and 3 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 9-chloro-3-(2-methoxyethyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one?
The CAS number of 9-chloro-3-(2-methoxyethyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one is 862209-48-1.
What is the molecular formula of 9-chloro-3-(2-methoxyethyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one?
The molecular formula of 9-chloro-3-(2-methoxyethyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one is C13H12ClN3O2.
What is the molecular weight of 9-chloro-3-(2-methoxyethyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one?
The molecular weight of 9-chloro-3-(2-methoxyethyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one is 277.06 g/mol.
Where can I buy 9-chloro-3-(2-methoxyethyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one?
You can request a quote for 9-chloro-3-(2-methoxyethyl)-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 9-chloro-3-(2-methoxyethyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one?
Yes, KEHONG BIO provides custom synthesis services for 9-chloro-3-(2-methoxyethyl)-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.