![N-(prop-2-en-1-yl)-5H-pyrimido[5,4-b]indol-4-amine structure](/static/products/847/847376-74-3.png)
N-(prop-2-en-1-yl)-5H-pyrimido[5,4-b]indol-4-amine
TL;DR: N-(prop-2-en-1-yl)-5H-pyrimido[5,4-b]indol-4-amine (CAS 847376-74-3) is a chemical compound with molecular formula C13H12N4 and molecular weight 224.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-prop-2-enyl-5H-pyrimido[5,4-b]indol-4-amine
Also Known As: N-allyl-5H-pyrimido[5,4-b]indol-4-amine, N-prop-2-enyl-5H-pyrimido[5,4-b]indol-4-amine, N-(prop-2-en-1-yl)-5H-pyrimido[5,4-b]indol-4-amine
| Molecular Formula | C13H12N4 |
|---|---|
| Molecular Weight | 224.11 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 53.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 224.1062 |
| Heavy Atoms | 17 |
| Complexity | 281.0 |
Chemical Identifiers
| CAS Number | 847376-74-3 |
|---|---|
| SMILES | C=CCNC1=NC=NC2=C1NC3=CC=CC=C32 |
| InChIKey | IIZRBYYJFUQYHY-UHFFFAOYSA-N |
Product Overview
N-(prop-2-en-1-yl)-5H-pyrimido[5,4-b]indol-4-amine (CAS 847376-74-3), with molecular formula C13H12N4 and molecular weight 224.11 g/mol. IUPAC: N-prop-2-enyl-5H-pyrimido[5,4-b]indol-4-amine.
Chemical Property Profile of N-(prop-2-en-1-yl)-5H-pyrimido[5,4-b]indol-4-amine
Property Insights of N-(prop-2-en-1-yl)-5H-pyrimido[5,4-b]indol-4-amine
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(prop-2-en-1-yl)-5H-pyrimido[5,4-b]indol-4-amine. With a topological polar surface area (TPSA) of 53.6 Ų, N-(prop-2-en-1-yl)-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-(prop-2-en-1-yl)-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-(prop-2-en-1-yl)-5H-pyrimido[5,4-b]indol-4-amine?
The CAS number of N-(prop-2-en-1-yl)-5H-pyrimido[5,4-b]indol-4-amine is 847376-74-3.
What is the molecular formula of N-(prop-2-en-1-yl)-5H-pyrimido[5,4-b]indol-4-amine?
The molecular formula of N-(prop-2-en-1-yl)-5H-pyrimido[5,4-b]indol-4-amine is C13H12N4.
What is the molecular weight of N-(prop-2-en-1-yl)-5H-pyrimido[5,4-b]indol-4-amine?
The molecular weight of N-(prop-2-en-1-yl)-5H-pyrimido[5,4-b]indol-4-amine is 224.11 g/mol.
Where can I buy N-(prop-2-en-1-yl)-5H-pyrimido[5,4-b]indol-4-amine?
You can request a quote for N-(prop-2-en-1-yl)-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-(prop-2-en-1-yl)-5H-pyrimido[5,4-b]indol-4-amine?
Yes, KEHONG BIO provides custom synthesis services for N-(prop-2-en-1-yl)-5H-pyrimido[5,4-b]indol-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.