1,3-bis(1H-pyrrol-2-yl)prop-2-en-1-one
TL;DR: 1,3-bis(1H-pyrrol-2-yl)prop-2-en-1-one (CAS 4036-11-7) is a chemical compound with molecular formula C11H10N2O and molecular weight 186.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-bis(1H-pyrrol-2-yl)prop-2-en-1-one
Also Known As: 1,3-bis-(1h-pyrrol-2-yl)-propenone, 1,3-bis(1H-pyrrol-2-yl)prop-2-en-1-one
| Molecular Formula | C11H10N2O |
|---|---|
| Molecular Weight | 186.08 g/mol |
| LogP | 2.2389 |
| Topological Polar Surface Area | 48.65 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 186.07932 |
| Heavy Atoms | 14 |
| Complexity | 423.81787 |
Chemical Identifiers
| CAS Number | 4036-11-7 |
|---|---|
| SMILES | C1=CNC(=C1)C=CC(=O)C2=CC=CN2 |
Product Overview
1,3-bis(1H-pyrrol-2-yl)prop-2-en-1-one (CAS 4036-11-7), with molecular formula C11H10N2O and molecular weight 186.08 g/mol. IUPAC: 1,3-bis(1H-pyrrol-2-yl)prop-2-en-1-one.
Chemical Property Profile of 1,3-bis(1H-pyrrol-2-yl)prop-2-en-1-one
Property Insights of 1,3-bis(1H-pyrrol-2-yl)prop-2-en-1-one
The XLogP value of 2.2389 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-bis(1H-pyrrol-2-yl)prop-2-en-1-one. With a topological polar surface area (TPSA) of 48.65 Ų, 1,3-bis(1H-pyrrol-2-yl)prop-2-en-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-bis(1H-pyrrol-2-yl)prop-2-en-1-one has 2 hydrogen bond donor(s) and 1 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 1,3-bis(1H-pyrrol-2-yl)prop-2-en-1-one?
The CAS number of 1,3-bis(1H-pyrrol-2-yl)prop-2-en-1-one is 4036-11-7.
What is the molecular formula of 1,3-bis(1H-pyrrol-2-yl)prop-2-en-1-one?
The molecular formula of 1,3-bis(1H-pyrrol-2-yl)prop-2-en-1-one is C11H10N2O.
What is the molecular weight of 1,3-bis(1H-pyrrol-2-yl)prop-2-en-1-one?
The molecular weight of 1,3-bis(1H-pyrrol-2-yl)prop-2-en-1-one is 186.08 g/mol.
Where can I buy 1,3-bis(1H-pyrrol-2-yl)prop-2-en-1-one?
You can request a quote for 1,3-bis(1H-pyrrol-2-yl)prop-2-en-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-bis(1H-pyrrol-2-yl)prop-2-en-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1,3-bis(1H-pyrrol-2-yl)prop-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.