![3-(3-(4-methylpiperazin-1-yl)propyl)-3H-pyrimido[5,4-b]indol-4(5H)-one structure](/static/products/895/895904-05-9.png)
3-(3-(4-methylpiperazin-1-yl)propyl)-3H-pyrimido[5,4-b]indol-4(5H)-one
TL;DR: 3-(3-(4-methylpiperazin-1-yl)propyl)-3H-pyrimido[5,4-b]indol-4(5H)-one (CAS 895904-05-9) is a chemical compound with molecular formula C18H23N5O and molecular weight 325.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-(4-methylpiperazin-1-yl)propyl]-5H-pyrimido[5,4-b]indol-4-one
Also Known As: 3-(3-(4-methylpiperazin-1-yl)propyl)-3H-pyrimido[5,4-b]indol-4(5H)-one, 3-[3-(4-methylpiperazin-1-yl)propyl]-5H-pyrimido[5,4-b]indol-4-one, 3-[3-(4-methylpiperazin-1-yl)propyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
| Molecular Formula | C18H23N5O |
|---|---|
| Molecular Weight | 325.19 g/mol |
| LogP | 1.5153 |
| Topological Polar Surface Area | 57.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 325.19025 |
| Heavy Atoms | 24 |
| Complexity | 904.5494 |
Chemical Identifiers
| CAS Number | 895904-05-9 |
|---|---|
| SMILES | CN1CCN(CC1)CCCN2C=NC3=C(C2=O)NC4=CC=CC=C43 |
Product Overview
3-(3-(4-methylpiperazin-1-yl)propyl)-3H-pyrimido[5,4-b]indol-4(5H)-one (CAS 895904-05-9), with molecular formula C18H23N5O and molecular weight 325.19 g/mol. IUPAC: 3-[3-(4-methylpiperazin-1-yl)propyl]-5H-pyrimido[5,4-b]indol-4-one.
Chemical Property Profile of 3-(3-(4-methylpiperazin-1-yl)propyl)-3H-pyrimido[5,4-b]indol-4(5H)-one
Property Insights of 3-(3-(4-methylpiperazin-1-yl)propyl)-3H-pyrimido[5,4-b]indol-4(5H)-one
The XLogP value of 1.5153 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3-(4-methylpiperazin-1-yl)propyl)-3H-pyrimido[5,4-b]indol-4(5H)-one. With a topological polar surface area (TPSA) of 57.16 Ų, 3-(3-(4-methylpiperazin-1-yl)propyl)-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, 3-(3-(4-methylpiperazin-1-yl)propyl)-3H-pyrimido[5,4-b]indol-4(5H)-one has 1 hydrogen bond donor(s) and 4 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 3-(3-(4-methylpiperazin-1-yl)propyl)-3H-pyrimido[5,4-b]indol-4(5H)-one?
The CAS number of 3-(3-(4-methylpiperazin-1-yl)propyl)-3H-pyrimido[5,4-b]indol-4(5H)-one is 895904-05-9.
What is the molecular formula of 3-(3-(4-methylpiperazin-1-yl)propyl)-3H-pyrimido[5,4-b]indol-4(5H)-one?
The molecular formula of 3-(3-(4-methylpiperazin-1-yl)propyl)-3H-pyrimido[5,4-b]indol-4(5H)-one is C18H23N5O.
What is the molecular weight of 3-(3-(4-methylpiperazin-1-yl)propyl)-3H-pyrimido[5,4-b]indol-4(5H)-one?
The molecular weight of 3-(3-(4-methylpiperazin-1-yl)propyl)-3H-pyrimido[5,4-b]indol-4(5H)-one is 325.19 g/mol.
Where can I buy 3-(3-(4-methylpiperazin-1-yl)propyl)-3H-pyrimido[5,4-b]indol-4(5H)-one?
You can request a quote for 3-(3-(4-methylpiperazin-1-yl)propyl)-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 3-(3-(4-methylpiperazin-1-yl)propyl)-3H-pyrimido[5,4-b]indol-4(5H)-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-(4-methylpiperazin-1-yl)propyl)-3H-pyrimido[5,4-b]indol-4(5H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.