Acetic acid, (2-benzothiazolylthio)-, (phenylmethylene)hydrazide
TL;DR: Acetic acid, (2-benzothiazolylthio)-, (phenylmethylene)hydrazide (CAS 69560-31-2) is a chemical compound with molecular formula C16H13N3OS2 and molecular weight 327.05 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)-benzylideneamino]acetamide
Also Known As: (2-Benzothiazolylthio)acetic acid (phenylmethylene)hydrazide, BAS 00536114, ACETIC ACID, (2-BENZOTHIAZOLYLTHIO)-, (PHENYLMETHYLENE)HYDRAZIDE, Benzaldehyde [(benzothiazol-2-ylthio)acetyl]hydrazone, 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-benzylideneamino]acetamide
| Molecular Formula | C16H13N3OS2 |
|---|---|
| Molecular Weight | 327.05 g/mol |
| LogP | 3.5387 |
| Topological Polar Surface Area | 54.35 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 327.05002 |
| Heavy Atoms | 22 |
| Complexity | 766.2708 |
Chemical Identifiers
| CAS Number | 69560-31-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C=N/NC(=O)CSC2=NC3=CC=CC=C3S2 |
Product Overview
Acetic acid, (2-benzothiazolylthio)-, (phenylmethylene)hydrazide (CAS 69560-31-2), with molecular formula C16H13N3OS2 and molecular weight 327.05 g/mol. IUPAC: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-benzylideneamino]acetamide.
Chemical Property Profile of Acetic acid, (2-benzothiazolylthio)-, (phenylmethylene)hydrazide
Property Insights of Acetic acid, (2-benzothiazolylthio)-, (phenylmethylene)hydrazide
The XLogP value of 3.5387 indicates that Acetic acid, (2-benzothiazolylthio)-, (phenylmethylene)hydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.35 Ų, Acetic acid, (2-benzothiazolylthio)-, (phenylmethylene)hydrazide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid, (2-benzothiazolylthio)-, (phenylmethylene)hydrazide has 1 hydrogen bond donor(s) and 5 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 Acetic acid, (2-benzothiazolylthio)-, (phenylmethylene)hydrazide?
The CAS number of Acetic acid, (2-benzothiazolylthio)-, (phenylmethylene)hydrazide is 69560-31-2.
What is the molecular formula of Acetic acid, (2-benzothiazolylthio)-, (phenylmethylene)hydrazide?
The molecular formula of Acetic acid, (2-benzothiazolylthio)-, (phenylmethylene)hydrazide is C16H13N3OS2.
What is the molecular weight of Acetic acid, (2-benzothiazolylthio)-, (phenylmethylene)hydrazide?
The molecular weight of Acetic acid, (2-benzothiazolylthio)-, (phenylmethylene)hydrazide is 327.05 g/mol.
Where can I buy Acetic acid, (2-benzothiazolylthio)-, (phenylmethylene)hydrazide?
You can request a quote for Acetic acid, (2-benzothiazolylthio)-, (phenylmethylene)hydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid, (2-benzothiazolylthio)-, (phenylmethylene)hydrazide?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, (2-benzothiazolylthio)-, (phenylmethylene)hydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.