ChemDiv1_019440
TL;DR: ChemDiv1_019440 (CAS 302936-68-1) is a chemical compound with molecular formula C28H22N4S and molecular weight 446.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(4-methylphenyl)-3-phenyl-1,2,4-thiadiazol-5-ylidene]-N'-phenylbenzenecarboximidamide
Also Known As: ChemDiv1_019440, N-[(5Z)-2-(4-methylphenyl)-3-phenyl-1,2,4-thiadiazol-5(2H)-ylidene]-N'-phenylbenzenecarboximidamide, (1Z,NZ)-N'-phenyl-N-(3-phenyl-2-(p-tolyl)-1,2,4-thiadiazol-5(2H)-ylidene)benzimidamide, N-[2-(4-methylphenyl)-3-phenyl-1,2,4-thiadiazol-5-ylidene]-N'-phenylbenzenecarboximidamide, 5-((2E)-2,3-diphenyl-1,3-diazaprop-2-enylidene)-2-(4-methylphenyl)-3-phenyl-1, 2,4-thiadiazoline
| Molecular Formula | C28H22N4S |
|---|---|
| Molecular Weight | 446.16 g/mol |
| LogP | 6.58842 |
| Topological Polar Surface Area | 42.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 446.15652 |
| Heavy Atoms | 33 |
| Complexity | 1433.084 |
Chemical Identifiers
| CAS Number | 302936-68-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=NC(=NC(=NC3=CC=CC=C3)C4=CC=CC=C4)S2)C5=CC=CC=C5 |
Product Overview
ChemDiv1_019440 (CAS 302936-68-1), with molecular formula C28H22N4S and molecular weight 446.16 g/mol. IUPAC: N-[2-(4-methylphenyl)-3-phenyl-1,2,4-thiadiazol-5-ylidene]-N'-phenylbenzenecarboximidamide.
Chemical Property Profile of ChemDiv1_019440
Property Insights of ChemDiv1_019440
The XLogP value of 6.58842 indicates that ChemDiv1_019440 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.54 Ų, ChemDiv1_019440 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_019440 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_019440?
The CAS number of ChemDiv1_019440 is 302936-68-1.
What is the molecular formula of ChemDiv1_019440?
The molecular formula of ChemDiv1_019440 is C28H22N4S.
What is the molecular weight of ChemDiv1_019440?
The molecular weight of ChemDiv1_019440 is 446.16 g/mol.
Where can I buy ChemDiv1_019440?
You can request a quote for ChemDiv1_019440 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_019440?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_019440 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.