BU-E 75
TL;DR: BU-E 75 (CAS 114667-74-2) is a chemical compound with molecular formula C21H24F2N6 and molecular weight 398.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-(3,4-difluorophenyl)-3-pyridin-2-ylpropyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine
Also Known As: BU-E 75, Bua 75, BU-E-75, 1-[3-(3,4-difluorophenyl)-3-pyridin-2-ylpropyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine, Guanidine, N-(3-(3,4-difluorophenyl)-3-(2-pyridinyl)propyl)-N'-(3-(1H-imidazol-4-yl)propyl)-
| Molecular Formula | C21H24F2N6 |
|---|---|
| Molecular Weight | 398.20 g/mol |
| LogP | 3.142 |
| Topological Polar Surface Area | 91.98 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 398.20306 |
| Heavy Atoms | 29 |
| Complexity | 912.1855 |
Chemical Identifiers
| CAS Number | 114667-74-2 |
|---|---|
| SMILES | C1=CC=NC(=C1)C(CCNC(=NCCCC2=CN=CN2)N)C3=CC(=C(C=C3)F)F |
Product Overview
BU-E 75 (CAS 114667-74-2), with molecular formula C21H24F2N6 and molecular weight 398.20 g/mol. IUPAC: 1-[3-(3,4-difluorophenyl)-3-pyridin-2-ylpropyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine.
Chemical Property Profile of BU-E 75
Property Insights of BU-E 75
The XLogP value of 3.142 indicates that BU-E 75 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.98 Ų falls within the moderate polarity range, balancing permeability and solubility for BU-E 75. Following Lipinski's Rule of Five, BU-E 75 has 3 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 BU-E 75?
The CAS number of BU-E 75 is 114667-74-2.
What is the molecular formula of BU-E 75?
The molecular formula of BU-E 75 is C21H24F2N6.
What is the molecular weight of BU-E 75?
The molecular weight of BU-E 75 is 398.20 g/mol.
Where can I buy BU-E 75?
You can request a quote for BU-E 75 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BU-E 75?
Yes, KEHONG BIO provides custom synthesis services for BU-E 75 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.