BAS 01024176
TL;DR: BAS 01024176 (CAS 330828-57-4) is a chemical compound with molecular formula C28H21N5O2 and molecular weight 459.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-[(11,12-diphenyl-10-oxa-3,5,6,8-tetrazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-4-yl)methoxy]-1-phenylethanimine
Also Known As: BAS 01024176, AE-848/12916028, (1E)-N-[(8,9-diphenylfuro[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)methoxy]-1-phenylethanimine, (E)-acetophenone O-((8,9-diphenylfuro[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)methyl) oxime, 1-phenylethanone O-[(8,9-diphenylfuro[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)methyl]oxime
| Molecular Formula | C28H21N5O2 |
|---|---|
| Molecular Weight | 459.17 g/mol |
| LogP | 6.1453 |
| Topological Polar Surface Area | 77.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 459.16953 |
| Heavy Atoms | 35 |
| Complexity | 1638.8394 |
Chemical Identifiers
| CAS Number | 330828-57-4 |
|---|---|
| SMILES | C/C(=N\OCC1=NN2C=NC3=C(C2=N1)C(=C(O3)C4=CC=CC=C4)C5=CC=CC=C5)/C6=CC=CC=C6 |
Product Overview
BAS 01024176 (CAS 330828-57-4), with molecular formula C28H21N5O2 and molecular weight 459.17 g/mol. IUPAC: (E)-N-[(11,12-diphenyl-10-oxa-3,5,6,8-tetrazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-4-yl)methoxy]-1-phenylethanimine.
Chemical Property Profile of BAS 01024176
Property Insights of BAS 01024176
The XLogP value of 6.1453 indicates that BAS 01024176 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.81 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01024176. Following Lipinski's Rule of Five, BAS 01024176 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01024176?
The CAS number of BAS 01024176 is 330828-57-4.
What is the molecular formula of BAS 01024176?
The molecular formula of BAS 01024176 is C28H21N5O2.
What is the molecular weight of BAS 01024176?
The molecular weight of BAS 01024176 is 459.17 g/mol.
Where can I buy BAS 01024176?
You can request a quote for BAS 01024176 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01024176?
Yes, KEHONG BIO provides custom synthesis services for BAS 01024176 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.