![9-chloro-3-(2-(diisopropylamino)ethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one structure](/static/products/849/849910-53-8.png)
9-chloro-3-(2-(diisopropylamino)ethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one
TL;DR: 9-chloro-3-(2-(diisopropylamino)ethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one (CAS 849910-53-8) is a chemical compound with molecular formula C18H23ClN4O and molecular weight 346.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-chloro-3-[2-[di(propan-2-yl)amino]ethyl]-5H-pyrimido[5,4-b]indol-4-one
Also Known As: 9-chloro-3-(2-(diisopropylamino)ethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one, 9-chloro-3-[2-(dipropan-2-ylamino)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one, 9-chloro-3-[2-[di(propan-2-yl)amino]ethyl]-5H-pyrimido[5,4-b]indol-4-one
| Molecular Formula | C18H23ClN4O |
|---|---|
| Molecular Weight | 346.16 g/mol |
| LogP | 3.65 |
| Topological Polar Surface Area | 53.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 346.15604 |
| Heavy Atoms | 24 |
| Complexity | 917.79956 |
Chemical Identifiers
| CAS Number | 849910-53-8 |
|---|---|
| SMILES | CC(C)N(CCN1C=NC2=C(C1=O)NC3=C2C(=CC=C3)Cl)C(C)C |
Product Overview
9-chloro-3-(2-(diisopropylamino)ethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one (CAS 849910-53-8), with molecular formula C18H23ClN4O and molecular weight 346.16 g/mol. IUPAC: 9-chloro-3-[2-[di(propan-2-yl)amino]ethyl]-5H-pyrimido[5,4-b]indol-4-one.
Chemical Property Profile of 9-chloro-3-(2-(diisopropylamino)ethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one
Property Insights of 9-chloro-3-(2-(diisopropylamino)ethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one
The XLogP value of 3.65 indicates that 9-chloro-3-(2-(diisopropylamino)ethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.92 Ų, 9-chloro-3-(2-(diisopropylamino)ethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-chloro-3-(2-(diisopropylamino)ethyl)-3H-pyrimido[5,4-b]indol-4(5H)-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-(diisopropylamino)ethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one?
The CAS number of 9-chloro-3-(2-(diisopropylamino)ethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one is 849910-53-8.
What is the molecular formula of 9-chloro-3-(2-(diisopropylamino)ethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one?
The molecular formula of 9-chloro-3-(2-(diisopropylamino)ethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one is C18H23ClN4O.
What is the molecular weight of 9-chloro-3-(2-(diisopropylamino)ethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one?
The molecular weight of 9-chloro-3-(2-(diisopropylamino)ethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one is 346.16 g/mol.
Where can I buy 9-chloro-3-(2-(diisopropylamino)ethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one?
You can request a quote for 9-chloro-3-(2-(diisopropylamino)ethyl)-3H-pyrimido[5,4-b]indol-4(5H)-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-(diisopropylamino)ethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one?
Yes, KEHONG BIO provides custom synthesis services for 9-chloro-3-(2-(diisopropylamino)ethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.