N-methyl-1,1-dioxo-N-phenyl-1,2-benzothiazol-3-amine
TL;DR: N-methyl-1,1-dioxo-N-phenyl-1,2-benzothiazol-3-amine (CAS 313508-56-4) is a chemical compound with molecular formula C14H12N2O2S and molecular weight 272.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-1,1-dioxo-N-phenyl-1,2-benzothiazol-3-amine
Also Known As: BAS 00511615, BIM-0024791.P001, AH-034/08304012, AH-034/11366523, N-methyl-1,1-dioxo-N-phenyl-1,2-benzothiazol-3-amine
| Molecular Formula | C14H12N2O2S |
|---|---|
| Molecular Weight | 272.06 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 58.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 272.06195 |
| Heavy Atoms | 19 |
| Complexity | 460.0 |
Chemical Identifiers
| CAS Number | 313508-56-4 |
|---|---|
| SMILES | CN(C1=CC=CC=C1)C2=NS(=O)(=O)C3=CC=CC=C32 |
| InChIKey | FUXFTDJABURRCY-UHFFFAOYSA-N |
Product Overview
N-methyl-1,1-dioxo-N-phenyl-1,2-benzothiazol-3-amine (CAS 313508-56-4), with molecular formula C14H12N2O2S and molecular weight 272.06 g/mol. IUPAC: N-methyl-1,1-dioxo-N-phenyl-1,2-benzothiazol-3-amine.
Chemical Property Profile of N-methyl-1,1-dioxo-N-phenyl-1,2-benzothiazol-3-amine
Property Insights of N-methyl-1,1-dioxo-N-phenyl-1,2-benzothiazol-3-amine
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-methyl-1,1-dioxo-N-phenyl-1,2-benzothiazol-3-amine. With a topological polar surface area (TPSA) of 58.1 Ų, N-methyl-1,1-dioxo-N-phenyl-1,2-benzothiazol-3-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-methyl-1,1-dioxo-N-phenyl-1,2-benzothiazol-3-amine has 0 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-methyl-1,1-dioxo-N-phenyl-1,2-benzothiazol-3-amine?
The CAS number of N-methyl-1,1-dioxo-N-phenyl-1,2-benzothiazol-3-amine is 313508-56-4.
What is the molecular formula of N-methyl-1,1-dioxo-N-phenyl-1,2-benzothiazol-3-amine?
The molecular formula of N-methyl-1,1-dioxo-N-phenyl-1,2-benzothiazol-3-amine is C14H12N2O2S.
What is the molecular weight of N-methyl-1,1-dioxo-N-phenyl-1,2-benzothiazol-3-amine?
The molecular weight of N-methyl-1,1-dioxo-N-phenyl-1,2-benzothiazol-3-amine is 272.06 g/mol.
Where can I buy N-methyl-1,1-dioxo-N-phenyl-1,2-benzothiazol-3-amine?
You can request a quote for N-methyl-1,1-dioxo-N-phenyl-1,2-benzothiazol-3-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-methyl-1,1-dioxo-N-phenyl-1,2-benzothiazol-3-amine?
Yes, KEHONG BIO provides custom synthesis services for N-methyl-1,1-dioxo-N-phenyl-1,2-benzothiazol-3-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.