3-(N-(2-Naphthyl)-N-phenylaminomethyl)benzothiazole-2(3H)-thione
TL;DR: 3-(N-(2-Naphthyl)-N-phenylaminomethyl)benzothiazole-2(3H)-thione (CAS 7149-52-2) is a chemical compound with molecular formula C24H18N2S2 and molecular weight 398.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(N-naphthalen-2-ylanilino)methyl]-1,3-benzothiazole-2-thione
Also Known As: 3-(N-(2-NAPHTHYL)-N-PHENYLAMINOMETHYL)BENZOTHIAZOLE-2(3H)-THIONE, 3-[(N-naphthalen-2-ylanilino)methyl]-1,3-benzothiazole-2-thione, 3-((Naphthalen-2-yl(phenyl)amino)methyl)benzo[d]thiazole-2(3H)-thione, 3-[(2-naphthylanilino)methyl]-1,3-benzothiazole-2(3H)-thione, 3-[(N-naphthalen-2-ylanilino)methyl]-1,3-benzothiazole-2-thi
| Molecular Formula | C24H18N2S2 |
|---|---|
| Molecular Weight | 398.09 g/mol |
| LogP | 7.2 |
| Topological Polar Surface Area | 63.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 398.09116 |
| Heavy Atoms | 28 |
| Complexity | 547.0 |
Chemical Identifiers
| CAS Number | 7149-52-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)N(CN2C3=CC=CC=C3SC2=S)C4=CC5=CC=CC=C5C=C4 |
| InChIKey | IAMQAIKSGMHQQD-UHFFFAOYSA-N |
Product Overview
3-(N-(2-Naphthyl)-N-phenylaminomethyl)benzothiazole-2(3H)-thione (CAS 7149-52-2), with molecular formula C24H18N2S2 and molecular weight 398.09 g/mol. IUPAC: 3-[(N-naphthalen-2-ylanilino)methyl]-1,3-benzothiazole-2-thione.
Chemical Property Profile of 3-(N-(2-Naphthyl)-N-phenylaminomethyl)benzothiazole-2(3H)-thione
Property Insights of 3-(N-(2-Naphthyl)-N-phenylaminomethyl)benzothiazole-2(3H)-thione
The XLogP value of 7.2 indicates that 3-(N-(2-Naphthyl)-N-phenylaminomethyl)benzothiazole-2(3H)-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(N-(2-Naphthyl)-N-phenylaminomethyl)benzothiazole-2(3H)-thione. Following Lipinski's Rule of Five, 3-(N-(2-Naphthyl)-N-phenylaminomethyl)benzothiazole-2(3H)-thione 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 3-(N-(2-Naphthyl)-N-phenylaminomethyl)benzothiazole-2(3H)-thione?
The CAS number of 3-(N-(2-Naphthyl)-N-phenylaminomethyl)benzothiazole-2(3H)-thione is 7149-52-2.
What is the molecular formula of 3-(N-(2-Naphthyl)-N-phenylaminomethyl)benzothiazole-2(3H)-thione?
The molecular formula of 3-(N-(2-Naphthyl)-N-phenylaminomethyl)benzothiazole-2(3H)-thione is C24H18N2S2.
What is the molecular weight of 3-(N-(2-Naphthyl)-N-phenylaminomethyl)benzothiazole-2(3H)-thione?
The molecular weight of 3-(N-(2-Naphthyl)-N-phenylaminomethyl)benzothiazole-2(3H)-thione is 398.09 g/mol.
Where can I buy 3-(N-(2-Naphthyl)-N-phenylaminomethyl)benzothiazole-2(3H)-thione?
You can request a quote for 3-(N-(2-Naphthyl)-N-phenylaminomethyl)benzothiazole-2(3H)-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(N-(2-Naphthyl)-N-phenylaminomethyl)benzothiazole-2(3H)-thione?
Yes, KEHONG BIO provides custom synthesis services for 3-(N-(2-Naphthyl)-N-phenylaminomethyl)benzothiazole-2(3H)-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.