Methyl (4-(1H-imidazo(4,5-B)phenazin-2-YL)anilino)carbothioylcarbamate
TL;DR: Methyl (4-(1H-imidazo(4,5-B)phenazin-2-YL)anilino)carbothioylcarbamate (CAS 303059-16-7) is a chemical compound with molecular formula C22H16N6O2S and molecular weight 428.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-[[4-(10H-imidazo[4,5-b]phenazin-2-yl)phenyl]carbamothioyl]carbamate
Also Known As: Methyl (4-(1h-imidazo(4,5-b)phenazin-2-yl)anilino)carbothioylcarbamate, methyl N-[[4-(1H-imidazo[4,5-b]phenazin-2-yl)phenyl]carbamothioyl]carbamate, 663-895-2, RefChem:812348
| Molecular Formula | C22H16N6O2S |
|---|---|
| Molecular Weight | 428.11 g/mol |
| LogP | 4.3791 |
| Topological Polar Surface Area | 104.82 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 428.10553 |
| Heavy Atoms | 31 |
| Complexity | 1390.214 |
Chemical Identifiers
| CAS Number | 303059-16-7 |
|---|---|
| SMILES | COC(=O)NC(=S)NC1=CC=C(C=C1)C2=NC3=CC4=NC5=CC=CC=C5NC4=CC3=N2 |
Product Overview
Methyl (4-(1H-imidazo(4,5-B)phenazin-2-YL)anilino)carbothioylcarbamate (CAS 303059-16-7), with molecular formula C22H16N6O2S and molecular weight 428.11 g/mol. IUPAC: methyl N-[[4-(10H-imidazo[4,5-b]phenazin-2-yl)phenyl]carbamothioyl]carbamate.
Chemical Property Profile of Methyl (4-(1H-imidazo(4,5-B)phenazin-2-YL)anilino)carbothioylcarbamate
Property Insights of Methyl (4-(1H-imidazo(4,5-B)phenazin-2-YL)anilino)carbothioylcarbamate
The XLogP value of 4.3791 indicates that Methyl (4-(1H-imidazo(4,5-B)phenazin-2-YL)anilino)carbothioylcarbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.82 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl (4-(1H-imidazo(4,5-B)phenazin-2-YL)anilino)carbothioylcarbamate. Following Lipinski's Rule of Five, Methyl (4-(1H-imidazo(4,5-B)phenazin-2-YL)anilino)carbothioylcarbamate has 3 hydrogen bond donor(s) and 6 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 Methyl (4-(1H-imidazo(4,5-B)phenazin-2-YL)anilino)carbothioylcarbamate?
The CAS number of Methyl (4-(1H-imidazo(4,5-B)phenazin-2-YL)anilino)carbothioylcarbamate is 303059-16-7.
What is the molecular formula of Methyl (4-(1H-imidazo(4,5-B)phenazin-2-YL)anilino)carbothioylcarbamate?
The molecular formula of Methyl (4-(1H-imidazo(4,5-B)phenazin-2-YL)anilino)carbothioylcarbamate is C22H16N6O2S.
What is the molecular weight of Methyl (4-(1H-imidazo(4,5-B)phenazin-2-YL)anilino)carbothioylcarbamate?
The molecular weight of Methyl (4-(1H-imidazo(4,5-B)phenazin-2-YL)anilino)carbothioylcarbamate is 428.11 g/mol.
Where can I buy Methyl (4-(1H-imidazo(4,5-B)phenazin-2-YL)anilino)carbothioylcarbamate?
You can request a quote for Methyl (4-(1H-imidazo(4,5-B)phenazin-2-YL)anilino)carbothioylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl (4-(1H-imidazo(4,5-B)phenazin-2-YL)anilino)carbothioylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for Methyl (4-(1H-imidazo(4,5-B)phenazin-2-YL)anilino)carbothioylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.