4-Methylthio-N-phenyl-1,2-carbazoledicarboximide
TL;DR: 4-Methylthio-N-phenyl-1,2-carbazoledicarboximide (CAS 22359-21-3) is a chemical compound with molecular formula C21H14N2O2S and molecular weight 358.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methylsulfanyl-2-phenyl-10H-pyrrolo[3,4-a]carbazole-1,3-dione
Also Known As: 4-Methylthio-N-phenyl-1,2-carbazoledicarboximide, J1.396.082H, 4-Methylthio-N-phenyl-9H-carbazole-1,2-dicarbimide, 5-methylsulfanyl-2-phenyl-10H-pyrrolo[3,4-a]carbazole-1,3-dione, 2-Phenyl-5-(methylthio)pyrrolo[3,4-a]carbazole-1,3(2H,10H)-dione
| Molecular Formula | C21H14N2O2S |
|---|---|
| Molecular Weight | 358.08 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 78.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 358.0776 |
| Heavy Atoms | 26 |
| Complexity | 591.0 |
Chemical Identifiers
| CAS Number | 22359-21-3 |
|---|---|
| SMILES | CSC1=C2C3=CC=CC=C3NC2=C4C(=C1)C(=O)N(C4=O)C5=CC=CC=C5 |
| InChIKey | RBZQDGIAUXSAEV-UHFFFAOYSA-N |
Product Overview
4-Methylthio-N-phenyl-1,2-carbazoledicarboximide (CAS 22359-21-3), with molecular formula C21H14N2O2S and molecular weight 358.08 g/mol. IUPAC: 5-methylsulfanyl-2-phenyl-10H-pyrrolo[3,4-a]carbazole-1,3-dione.
Chemical Property Profile of 4-Methylthio-N-phenyl-1,2-carbazoledicarboximide
Property Insights of 4-Methylthio-N-phenyl-1,2-carbazoledicarboximide
The XLogP value of 4.4 indicates that 4-Methylthio-N-phenyl-1,2-carbazoledicarboximide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Methylthio-N-phenyl-1,2-carbazoledicarboximide. Following Lipinski's Rule of Five, 4-Methylthio-N-phenyl-1,2-carbazoledicarboximide 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 4-Methylthio-N-phenyl-1,2-carbazoledicarboximide?
The CAS number of 4-Methylthio-N-phenyl-1,2-carbazoledicarboximide is 22359-21-3.
What is the molecular formula of 4-Methylthio-N-phenyl-1,2-carbazoledicarboximide?
The molecular formula of 4-Methylthio-N-phenyl-1,2-carbazoledicarboximide is C21H14N2O2S.
What is the molecular weight of 4-Methylthio-N-phenyl-1,2-carbazoledicarboximide?
The molecular weight of 4-Methylthio-N-phenyl-1,2-carbazoledicarboximide is 358.08 g/mol.
Where can I buy 4-Methylthio-N-phenyl-1,2-carbazoledicarboximide?
You can request a quote for 4-Methylthio-N-phenyl-1,2-carbazoledicarboximide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methylthio-N-phenyl-1,2-carbazoledicarboximide?
Yes, KEHONG BIO provides custom synthesis services for 4-Methylthio-N-phenyl-1,2-carbazoledicarboximide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.