BIM-0003108.P001
TL;DR: BIM-0003108.P001 (CAS 313273-07-3) is a chemical compound with molecular formula C28H18N6O4S and molecular weight 534.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z)-6-benzyl-2-[[3-(3-nitrophenyl)-1-phenylpyrazol-4-yl]methylidene]-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione
Also Known As: BIM-0003108.P001, (2Z)-6-benzyl-2-[[3-(3-nitrophenyl)-1-phenylpyrazol-4-yl]methylidene]-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione, (2Z)-6-benzyl-2-{[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione, (Z)-6-benzyl-2-((3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl)methylene)-2H-thiazolo[3,2-b][1,2,4]triazine-3,7-dione, 6-benzyl-2-{[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]methylene}-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
| Molecular Formula | C28H18N6O4S |
|---|---|
| Molecular Weight | 534.11 g/mol |
| LogP | 3.4106 |
| Topological Polar Surface Area | 125.29 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 534.111 |
| Heavy Atoms | 39 |
| Complexity | 2016.8805 |
Chemical Identifiers
| CAS Number | 313273-07-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC2=NN3C(=O)/C(=C/C4=CN(N=C4C5=CC(=CC=C5)[N+](=O)[O-])C6=CC=CC=C6)/SC3=NC2=O |
Product Overview
BIM-0003108.P001 (CAS 313273-07-3), with molecular formula C28H18N6O4S and molecular weight 534.11 g/mol. IUPAC: (2Z)-6-benzyl-2-[[3-(3-nitrophenyl)-1-phenylpyrazol-4-yl]methylidene]-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione.
Chemical Property Profile of BIM-0003108.P001
Property Insights of BIM-0003108.P001
The XLogP value of 3.4106 indicates that BIM-0003108.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 125.29 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0003108.P001. Following Lipinski's Rule of Five, BIM-0003108.P001 has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BIM-0003108.P001?
The CAS number of BIM-0003108.P001 is 313273-07-3.
What is the molecular formula of BIM-0003108.P001?
The molecular formula of BIM-0003108.P001 is C28H18N6O4S.
What is the molecular weight of BIM-0003108.P001?
The molecular weight of BIM-0003108.P001 is 534.11 g/mol.
Where can I buy BIM-0003108.P001?
You can request a quote for BIM-0003108.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0003108.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0003108.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.