A3951/0168289
TL;DR: A3951/0168289 (CAS 727392-77-0) is a chemical compound with molecular formula C17H20N4O and molecular weight 296.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(furan-2-ylmethyl)-3-propyl-2,4-dihydro-[1,3,5]triazino[1,2-a]benzimidazole
Also Known As: A3951/0168289, 1-(furan-2-ylmethyl)-3-propyl-1,2,3,4-tetrahydro[1,3,5]triazino[1,2-a]benzimidazole, 1-(furan-2-ylmethyl)-3-propyl-1,2,3,4-tetrahydrobenzo[4,5]imidazo[1,2-a][1,3,5]triazine, 1-(furan-2-ylmethyl)-3-propyl-2,4-dihydro-[1,3,5]triazino[1,2-a]benzimidazole, [1,3,5]Triazino[1,2-a][1,3]benzimidazole, 1-(2-furanylmethyl)-1,2,3,4-tetrahydro-3-propyl-
| Molecular Formula | C17H20N4O |
|---|---|
| Molecular Weight | 296.16 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 37.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 296.1637 |
| Heavy Atoms | 22 |
| Complexity | 380.0 |
Chemical Identifiers
| CAS Number | 727392-77-0 |
|---|---|
| SMILES | CCCN1CN(C2=NC3=CC=CC=C3N2C1)CC4=CC=CO4 |
| InChIKey | ISOXPBYVJUUKPN-UHFFFAOYSA-N |
Product Overview
A3951/0168289 (CAS 727392-77-0), with molecular formula C17H20N4O and molecular weight 296.16 g/mol. IUPAC: 1-(furan-2-ylmethyl)-3-propyl-2,4-dihydro-[1,3,5]triazino[1,2-a]benzimidazole.
Chemical Property Profile of A3951/0168289
Property Insights of A3951/0168289
The XLogP value of 3.3 indicates that A3951/0168289 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.4 Ų, A3951/0168289 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A3951/0168289 has 0 hydrogen bond donor(s) and 4 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 A3951/0168289?
The CAS number of A3951/0168289 is 727392-77-0.
What is the molecular formula of A3951/0168289?
The molecular formula of A3951/0168289 is C17H20N4O.
What is the molecular weight of A3951/0168289?
The molecular weight of A3951/0168289 is 296.16 g/mol.
Where can I buy A3951/0168289?
You can request a quote for A3951/0168289 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3951/0168289?
Yes, KEHONG BIO provides custom synthesis services for A3951/0168289 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.