![8-chloro-4-(4-ethylpiperazin-1-yl)-5H-pyrimido[5,4-b]indole structure](/static/products/497/497864-74-1.png)
8-chloro-4-(4-ethylpiperazin-1-yl)-5H-pyrimido[5,4-b]indole
TL;DR: 8-chloro-4-(4-ethylpiperazin-1-yl)-5H-pyrimido[5,4-b]indole (CAS 497864-74-1) is a chemical compound with molecular formula C16H18ClN5 and molecular weight 315.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-chloro-4-(4-ethylpiperazin-1-yl)-5H-pyrimido[5,4-b]indole
Also Known As: 8-chloro-4-(4-ethylpiperazin-1-yl)-5H-pyrimido[5,4-b]indole
| Molecular Formula | C16H18ClN5 |
|---|---|
| Molecular Weight | 315.13 g/mol |
| LogP | 2.9064 |
| Topological Polar Surface Area | 48.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 315.12506 |
| Heavy Atoms | 22 |
| Complexity | 819.8757 |
Chemical Identifiers
| CAS Number | 497864-74-1 |
|---|---|
| SMILES | CCN1CCN(CC1)C2=NC=NC3=C2NC4=C3C=C(C=C4)Cl |
Product Overview
8-chloro-4-(4-ethylpiperazin-1-yl)-5H-pyrimido[5,4-b]indole (CAS 497864-74-1), with molecular formula C16H18ClN5 and molecular weight 315.13 g/mol. IUPAC: 8-chloro-4-(4-ethylpiperazin-1-yl)-5H-pyrimido[5,4-b]indole.
Chemical Property Profile of 8-chloro-4-(4-ethylpiperazin-1-yl)-5H-pyrimido[5,4-b]indole
Property Insights of 8-chloro-4-(4-ethylpiperazin-1-yl)-5H-pyrimido[5,4-b]indole
The XLogP value of 2.9064 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-chloro-4-(4-ethylpiperazin-1-yl)-5H-pyrimido[5,4-b]indole. With a topological polar surface area (TPSA) of 48.05 Ų, 8-chloro-4-(4-ethylpiperazin-1-yl)-5H-pyrimido[5,4-b]indole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-chloro-4-(4-ethylpiperazin-1-yl)-5H-pyrimido[5,4-b]indole 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 8-chloro-4-(4-ethylpiperazin-1-yl)-5H-pyrimido[5,4-b]indole?
The CAS number of 8-chloro-4-(4-ethylpiperazin-1-yl)-5H-pyrimido[5,4-b]indole is 497864-74-1.
What is the molecular formula of 8-chloro-4-(4-ethylpiperazin-1-yl)-5H-pyrimido[5,4-b]indole?
The molecular formula of 8-chloro-4-(4-ethylpiperazin-1-yl)-5H-pyrimido[5,4-b]indole is C16H18ClN5.
What is the molecular weight of 8-chloro-4-(4-ethylpiperazin-1-yl)-5H-pyrimido[5,4-b]indole?
The molecular weight of 8-chloro-4-(4-ethylpiperazin-1-yl)-5H-pyrimido[5,4-b]indole is 315.13 g/mol.
Where can I buy 8-chloro-4-(4-ethylpiperazin-1-yl)-5H-pyrimido[5,4-b]indole?
You can request a quote for 8-chloro-4-(4-ethylpiperazin-1-yl)-5H-pyrimido[5,4-b]indole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-chloro-4-(4-ethylpiperazin-1-yl)-5H-pyrimido[5,4-b]indole?
Yes, KEHONG BIO provides custom synthesis services for 8-chloro-4-(4-ethylpiperazin-1-yl)-5H-pyrimido[5,4-b]indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.