![N-benzyl-8-chloro-5H-pyrimido[5,4-b]indol-4-amine structure](/static/products/845/845902-39-8.png)
N-benzyl-8-chloro-5H-pyrimido[5,4-b]indol-4-amine
TL;DR: N-benzyl-8-chloro-5H-pyrimido[5,4-b]indol-4-amine (CAS 845902-39-8) is a chemical compound with molecular formula C17H13ClN4 and molecular weight 308.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-8-chloro-5H-pyrimido[5,4-b]indol-4-amine
Also Known As: N-benzyl-8-chloro-5H-pyrimido[5,4-b]indol-4-amine
| Molecular Formula | C17H13ClN4 |
|---|---|
| Molecular Weight | 308.08 g/mol |
| LogP | 4.3766 |
| Topological Polar Surface Area | 53.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 308.0829 |
| Heavy Atoms | 22 |
| Complexity | 946.864 |
Chemical Identifiers
| CAS Number | 845902-39-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC2=NC=NC3=C2NC4=C3C=C(C=C4)Cl |
Product Overview
N-benzyl-8-chloro-5H-pyrimido[5,4-b]indol-4-amine (CAS 845902-39-8), with molecular formula C17H13ClN4 and molecular weight 308.08 g/mol. IUPAC: N-benzyl-8-chloro-5H-pyrimido[5,4-b]indol-4-amine.
Chemical Property Profile of N-benzyl-8-chloro-5H-pyrimido[5,4-b]indol-4-amine
Property Insights of N-benzyl-8-chloro-5H-pyrimido[5,4-b]indol-4-amine
The XLogP value of 4.3766 indicates that N-benzyl-8-chloro-5H-pyrimido[5,4-b]indol-4-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.6 Ų, N-benzyl-8-chloro-5H-pyrimido[5,4-b]indol-4-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-benzyl-8-chloro-5H-pyrimido[5,4-b]indol-4-amine has 2 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 N-benzyl-8-chloro-5H-pyrimido[5,4-b]indol-4-amine?
The CAS number of N-benzyl-8-chloro-5H-pyrimido[5,4-b]indol-4-amine is 845902-39-8.
What is the molecular formula of N-benzyl-8-chloro-5H-pyrimido[5,4-b]indol-4-amine?
The molecular formula of N-benzyl-8-chloro-5H-pyrimido[5,4-b]indol-4-amine is C17H13ClN4.
What is the molecular weight of N-benzyl-8-chloro-5H-pyrimido[5,4-b]indol-4-amine?
The molecular weight of N-benzyl-8-chloro-5H-pyrimido[5,4-b]indol-4-amine is 308.08 g/mol.
Where can I buy N-benzyl-8-chloro-5H-pyrimido[5,4-b]indol-4-amine?
You can request a quote for N-benzyl-8-chloro-5H-pyrimido[5,4-b]indol-4-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-benzyl-8-chloro-5H-pyrimido[5,4-b]indol-4-amine?
Yes, KEHONG BIO provides custom synthesis services for N-benzyl-8-chloro-5H-pyrimido[5,4-b]indol-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.