N-(3,4-dimethylphenyl)-1,3-benzothiazol-2-amine
TL;DR: N-(3,4-dimethylphenyl)-1,3-benzothiazol-2-amine (CAS 852399-77-0) is a chemical compound with molecular formula C15H14N2S and molecular weight 254.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3,4-dimethylphenyl)-1,3-benzothiazol-2-amine
Also Known As: N-(3,4-dimethylphenyl)-1,3-benzothiazol-2-amine
| Molecular Formula | C15H14N2S |
|---|---|
| Molecular Weight | 254.09 g/mol |
| LogP | 4.65674 |
| Topological Polar Surface Area | 24.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 254.08777 |
| Heavy Atoms | 18 |
| Complexity | 667.53503 |
Chemical Identifiers
| CAS Number | 852399-77-0 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC2=NC3=CC=CC=C3S2)C |
Product Overview
N-(3,4-dimethylphenyl)-1,3-benzothiazol-2-amine (CAS 852399-77-0), with molecular formula C15H14N2S and molecular weight 254.09 g/mol. IUPAC: N-(3,4-dimethylphenyl)-1,3-benzothiazol-2-amine.
Chemical Property Profile of N-(3,4-dimethylphenyl)-1,3-benzothiazol-2-amine
Property Insights of N-(3,4-dimethylphenyl)-1,3-benzothiazol-2-amine
The XLogP value of 4.65674 indicates that N-(3,4-dimethylphenyl)-1,3-benzothiazol-2-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.92 Ų, N-(3,4-dimethylphenyl)-1,3-benzothiazol-2-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3,4-dimethylphenyl)-1,3-benzothiazol-2-amine has 1 hydrogen bond donor(s) and 3 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 N-(3,4-dimethylphenyl)-1,3-benzothiazol-2-amine?
The CAS number of N-(3,4-dimethylphenyl)-1,3-benzothiazol-2-amine is 852399-77-0.
What is the molecular formula of N-(3,4-dimethylphenyl)-1,3-benzothiazol-2-amine?
The molecular formula of N-(3,4-dimethylphenyl)-1,3-benzothiazol-2-amine is C15H14N2S.
What is the molecular weight of N-(3,4-dimethylphenyl)-1,3-benzothiazol-2-amine?
The molecular weight of N-(3,4-dimethylphenyl)-1,3-benzothiazol-2-amine is 254.09 g/mol.
Where can I buy N-(3,4-dimethylphenyl)-1,3-benzothiazol-2-amine?
You can request a quote for N-(3,4-dimethylphenyl)-1,3-benzothiazol-2-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3,4-dimethylphenyl)-1,3-benzothiazol-2-amine?
Yes, KEHONG BIO provides custom synthesis services for N-(3,4-dimethylphenyl)-1,3-benzothiazol-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.