BAS 00536119
TL;DR: BAS 00536119 (CAS 73718-48-6) is a chemical compound with molecular formula C18H18N4OS2 and molecular weight 370.09 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)-[4-(dimethylamino)phenyl]methylideneamino]acetamide
Also Known As: BAS 00536119, 4-(Dimethylamino)benzaldehyde [(benzothiazol-2-ylthio)acetyl]hydrazone, (Benzothiazol-2-ylsulfanyl)-acetic acid (4-dimethylamino-benzylidene)-hydrazide, (E)-2-(benzo[d]thiazol-2-ylthio)-N'-(4-(dimethylamino)benzylidene)acetohydrazide, 2-(1,3-benzothiazol-2-ylsulfanyl)-N'-{[4-(dimethylamino)phenyl]methylidene}acetohydrazide
| Molecular Formula | C18H18N4OS2 |
|---|---|
| Molecular Weight | 370.09 g/mol |
| LogP | 3.6047 |
| Topological Polar Surface Area | 57.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 370.0922 |
| Heavy Atoms | 25 |
| Complexity | 854.48724 |
Chemical Identifiers
| CAS Number | 73718-48-6 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)/C=N/NC(=O)CSC2=NC3=CC=CC=C3S2 |
Product Overview
BAS 00536119 (CAS 73718-48-6), with molecular formula C18H18N4OS2 and molecular weight 370.09 g/mol. IUPAC: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-[4-(dimethylamino)phenyl]methylideneamino]acetamide.
Chemical Property Profile of BAS 00536119
Property Insights of BAS 00536119
The XLogP value of 3.6047 indicates that BAS 00536119 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.59 Ų, BAS 00536119 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00536119 has 1 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 BAS 00536119?
The CAS number of BAS 00536119 is 73718-48-6.
What is the molecular formula of BAS 00536119?
The molecular formula of BAS 00536119 is C18H18N4OS2.
What is the molecular weight of BAS 00536119?
The molecular weight of BAS 00536119 is 370.09 g/mol.
Where can I buy BAS 00536119?
You can request a quote for BAS 00536119 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00536119?
Yes, KEHONG BIO provides custom synthesis services for BAS 00536119 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.