RefChem:1075558
TL;DR: RefChem:1075558 (CAS 94768-95-3) is a chemical compound with molecular formula C18H14N4O2S2 and molecular weight 382.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-(2-oxo-1,3-dihydroindol-3-yl)methylideneamino]acetamide
Also Known As: Acetic acid, (2-benzothiazolylthio)-, ((2,3-dihydro-2-oxo-1H-indol-3-yl)methylene)hydrazide, (2-Benzothiazolylthio)acetic acid ((2,3-dihydro-2-oxo-1H-indol-3-yl)methylene)hydrazide, RefChem:1075558
| Molecular Formula | C18H14N4O2S2 |
|---|---|
| Molecular Weight | 382.06 g/mol |
| LogP | 3.2263 |
| Topological Polar Surface Area | 83.45 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 382.05582 |
| Heavy Atoms | 26 |
| Complexity | 982.1036 |
Chemical Identifiers
| CAS Number | 94768-95-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(C(=O)N2)/C=N/NC(=O)CSC3=NC4=CC=CC=C4S3 |
Product Overview
RefChem:1075558 (CAS 94768-95-3), with molecular formula C18H14N4O2S2 and molecular weight 382.06 g/mol. IUPAC: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-(2-oxo-1,3-dihydroindol-3-yl)methylideneamino]acetamide.
Chemical Property Profile of RefChem:1075558
Property Insights of RefChem:1075558
The XLogP value of 3.2263 indicates that RefChem:1075558 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.45 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1075558. Following Lipinski's Rule of Five, RefChem:1075558 has 2 hydrogen bond donor(s) and 6 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 RefChem:1075558?
The CAS number of RefChem:1075558 is 94768-95-3.
What is the molecular formula of RefChem:1075558?
The molecular formula of RefChem:1075558 is C18H14N4O2S2.
What is the molecular weight of RefChem:1075558?
The molecular weight of RefChem:1075558 is 382.06 g/mol.
Where can I buy RefChem:1075558?
You can request a quote for RefChem:1075558 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1075558?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1075558 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.