CDS1_003611
TL;DR: CDS1_003611 (CAS 348577-07-1) is a chemical compound with molecular formula C15H14FN5 and molecular weight 283.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-N-(1,2,4-triazol-4-yl)methanimine
Also Known As: CDS1_003611, BIM-0011115.P001, AN-988/14609006, N-{(E)-[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-4H-1,2,4-triazol-4-amine, (E)-1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-N-(1,2,4-triazol-4-yl)methanimine
| Molecular Formula | C15H14FN5 |
|---|---|
| Molecular Weight | 283.12 g/mol |
| LogP | 2.70694 |
| Topological Polar Surface Area | 48.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 283.12332 |
| Heavy Atoms | 21 |
| Complexity | 769.25934 |
Chemical Identifiers
| CAS Number | 348577-07-1 |
|---|---|
| SMILES | CC1=CC(=C(N1C2=CC=C(C=C2)F)C)/C=N/N3C=NN=C3 |
Product Overview
CDS1_003611 (CAS 348577-07-1), with molecular formula C15H14FN5 and molecular weight 283.12 g/mol. IUPAC: (E)-1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-N-(1,2,4-triazol-4-yl)methanimine.
Chemical Property Profile of CDS1_003611
Property Insights of CDS1_003611
The XLogP value of 2.70694 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CDS1_003611. With a topological polar surface area (TPSA) of 48.0 Ų, CDS1_003611 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CDS1_003611 has 0 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 CDS1_003611?
The CAS number of CDS1_003611 is 348577-07-1.
What is the molecular formula of CDS1_003611?
The molecular formula of CDS1_003611 is C15H14FN5.
What is the molecular weight of CDS1_003611?
The molecular weight of CDS1_003611 is 283.12 g/mol.
Where can I buy CDS1_003611?
You can request a quote for CDS1_003611 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CDS1_003611?
Yes, KEHONG BIO provides custom synthesis services for CDS1_003611 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.