1,4-Butanediamine, N,N'-bis(1H-pyrrol-2-ylmethylene)-
TL;DR: 1,4-Butanediamine, N,N'-bis(1H-pyrrol-2-ylmethylene)- (CAS 14942-63-3) is a chemical compound with molecular formula C14H18N4 and molecular weight 242.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1H-pyrrol-2-yl)-N-[4-(1H-pyrrol-2-ylmethylideneamino)butyl]methanimine
Also Known As: Sulfanilanilide,4'-fluoro, 1,4-Butanediamine, N,N'-bis(1H-pyrrol-2-ylmethylene)-, J1.983.508A, N,N'-bis(pyrrol-2-ylidenemethyl)butane-1,4-diamine, (1E,7E)-1,8-dipyrrol-2-yl-2,7-diazaocta-1,7-diene
| Molecular Formula | C14H18N4 |
|---|---|
| Molecular Weight | 242.15 g/mol |
| LogP | 2.661 |
| Topological Polar Surface Area | 56.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 242.15315 |
| Heavy Atoms | 18 |
| Complexity | 419.63177 |
Chemical Identifiers
| CAS Number | 14942-63-3 |
|---|---|
| SMILES | C1=CNC(=C1)C=NCCCCN=CC2=CC=CN2 |
Product Overview
1,4-Butanediamine, N,N'-bis(1H-pyrrol-2-ylmethylene)- (CAS 14942-63-3), with molecular formula C14H18N4 and molecular weight 242.15 g/mol. IUPAC: 1-(1H-pyrrol-2-yl)-N-[4-(1H-pyrrol-2-ylmethylideneamino)butyl]methanimine.
Chemical Property Profile of 1,4-Butanediamine, N,N'-bis(1H-pyrrol-2-ylmethylene)-
Property Insights of 1,4-Butanediamine, N,N'-bis(1H-pyrrol-2-ylmethylene)-
The XLogP value of 2.661 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Butanediamine, N,N'-bis(1H-pyrrol-2-ylmethylene)-. With a topological polar surface area (TPSA) of 56.3 Ų, 1,4-Butanediamine, N,N'-bis(1H-pyrrol-2-ylmethylene)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Butanediamine, N,N'-bis(1H-pyrrol-2-ylmethylene)- has 2 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 1,4-Butanediamine, N,N'-bis(1H-pyrrol-2-ylmethylene)-?
The CAS number of 1,4-Butanediamine, N,N'-bis(1H-pyrrol-2-ylmethylene)- is 14942-63-3.
What is the molecular formula of 1,4-Butanediamine, N,N'-bis(1H-pyrrol-2-ylmethylene)-?
The molecular formula of 1,4-Butanediamine, N,N'-bis(1H-pyrrol-2-ylmethylene)- is C14H18N4.
What is the molecular weight of 1,4-Butanediamine, N,N'-bis(1H-pyrrol-2-ylmethylene)-?
The molecular weight of 1,4-Butanediamine, N,N'-bis(1H-pyrrol-2-ylmethylene)- is 242.15 g/mol.
Where can I buy 1,4-Butanediamine, N,N'-bis(1H-pyrrol-2-ylmethylene)-?
You can request a quote for 1,4-Butanediamine, N,N'-bis(1H-pyrrol-2-ylmethylene)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Butanediamine, N,N'-bis(1H-pyrrol-2-ylmethylene)-?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Butanediamine, N,N'-bis(1H-pyrrol-2-ylmethylene)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.