![4-[4-(1H-pyrrol-1-yl)phenyl]-2-pyrimidinamine structure](/static/products/6918/691870-09-4.webp)
4-[4-(1H-pyrrol-1-yl)phenyl]-2-pyrimidinamine
TL;DR: 4-[4-(1H-pyrrol-1-yl)phenyl]-2-pyrimidinamine (CAS 691870-09-4) is a chemical compound with molecular formula C14H12N4 and molecular weight 236.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-pyrrol-1-ylphenyl)pyrimidin-2-amine
Also Known As: 4-[4-(1H-pyrrol-1-yl)phenyl]-2-pyrimidinamine, 4-[4-(1H-pyrrol-1-yl)phenyl]pyrimidin-2-amine, 4-(4-pyrrol-1-ylphenyl)pyrimidin-2-amine, 4-(4-(1H-pyrrol-1-yl)phenyl)pyrimidin-2-amine, 4-[4-(pyrrol-1-yl)phenyl]pyrimidin-2-amine
| Molecular Formula | C14H12N4 |
|---|---|
| Molecular Weight | 236.11 g/mol |
| LogP | 2.5165 |
| Topological Polar Surface Area | 56.73 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 236.1062 |
| Heavy Atoms | 18 |
| Complexity | 641.82056 |
Chemical Identifiers
| CAS Number | 691870-09-4 |
|---|---|
| SMILES | C1=CN(C=C1)C2=CC=C(C=C2)C3=NC(=NC=C3)N |
Product Overview
4-[4-(1H-pyrrol-1-yl)phenyl]-2-pyrimidinamine (CAS 691870-09-4), with molecular formula C14H12N4 and molecular weight 236.11 g/mol. IUPAC: 4-(4-pyrrol-1-ylphenyl)pyrimidin-2-amine.
Chemical Property Profile of 4-[4-(1H-pyrrol-1-yl)phenyl]-2-pyrimidinamine
Property Insights of 4-[4-(1H-pyrrol-1-yl)phenyl]-2-pyrimidinamine
The XLogP value of 2.5165 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[4-(1H-pyrrol-1-yl)phenyl]-2-pyrimidinamine. With a topological polar surface area (TPSA) of 56.73 Ų, 4-[4-(1H-pyrrol-1-yl)phenyl]-2-pyrimidinamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[4-(1H-pyrrol-1-yl)phenyl]-2-pyrimidinamine 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 4-[4-(1H-pyrrol-1-yl)phenyl]-2-pyrimidinamine?
The CAS number of 4-[4-(1H-pyrrol-1-yl)phenyl]-2-pyrimidinamine is 691870-09-4.
What is the molecular formula of 4-[4-(1H-pyrrol-1-yl)phenyl]-2-pyrimidinamine?
The molecular formula of 4-[4-(1H-pyrrol-1-yl)phenyl]-2-pyrimidinamine is C14H12N4.
What is the molecular weight of 4-[4-(1H-pyrrol-1-yl)phenyl]-2-pyrimidinamine?
The molecular weight of 4-[4-(1H-pyrrol-1-yl)phenyl]-2-pyrimidinamine is 236.11 g/mol.
Where can I buy 4-[4-(1H-pyrrol-1-yl)phenyl]-2-pyrimidinamine?
You can request a quote for 4-[4-(1H-pyrrol-1-yl)phenyl]-2-pyrimidinamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[4-(1H-pyrrol-1-yl)phenyl]-2-pyrimidinamine?
Yes, KEHONG BIO provides custom synthesis services for 4-[4-(1H-pyrrol-1-yl)phenyl]-2-pyrimidinamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.