2-(1H-pyrrol-1-yl)pyrimidine
TL;DR: 2-(1H-pyrrol-1-yl)pyrimidine (CAS 114646-17-2) is a chemical compound with molecular formula C8H7N3 and molecular weight 145.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-pyrrol-1-ylpyrimidine
Also Known As: 2-(1H-pyrrol-1-yl)pyrimidine, 2-pyrrol-1-ylpyrimidine, 1-(2-PYRIMIDINYL)PYRROLE, 2-(pyrrol-1-yl)pyrimidine, 2-(1-PYRROLYL)PYRIMIDINE
| Molecular Formula | C8H7N3 |
|---|---|
| Molecular Weight | 145.06 g/mol |
| LogP | 1.2673 |
| Topological Polar Surface Area | 30.71 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 145.064 |
| Heavy Atoms | 11 |
| Complexity | 312.32794 |
Chemical Identifiers
| CAS Number | 114646-17-2 |
|---|---|
| SMILES | C1=CN(C=C1)C2=NC=CC=N2 |
Product Overview
2-(1H-pyrrol-1-yl)pyrimidine (CAS 114646-17-2), with molecular formula C8H7N3 and molecular weight 145.06 g/mol. IUPAC: 2-pyrrol-1-ylpyrimidine.
Chemical Property Profile of 2-(1H-pyrrol-1-yl)pyrimidine
Property Insights of 2-(1H-pyrrol-1-yl)pyrimidine
The XLogP value of 1.2673 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1H-pyrrol-1-yl)pyrimidine. With a topological polar surface area (TPSA) of 30.71 Ų, 2-(1H-pyrrol-1-yl)pyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1H-pyrrol-1-yl)pyrimidine has 0 hydrogen bond donor(s) and 2 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 2-(1H-pyrrol-1-yl)pyrimidine?
The CAS number of 2-(1H-pyrrol-1-yl)pyrimidine is 114646-17-2.
What is the molecular formula of 2-(1H-pyrrol-1-yl)pyrimidine?
The molecular formula of 2-(1H-pyrrol-1-yl)pyrimidine is C8H7N3.
What is the molecular weight of 2-(1H-pyrrol-1-yl)pyrimidine?
The molecular weight of 2-(1H-pyrrol-1-yl)pyrimidine is 145.06 g/mol.
Where can I buy 2-(1H-pyrrol-1-yl)pyrimidine?
You can request a quote for 2-(1H-pyrrol-1-yl)pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1H-pyrrol-1-yl)pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 2-(1H-pyrrol-1-yl)pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.