(Z)-2-(Carbamoylsulfanyl)-N'-(4-methylbenzenesulfonyl)-N-phenylethanimidamide
TL;DR: (Z)-2-(Carbamoylsulfanyl)-N'-(4-methylbenzenesulfonyl)-N-phenylethanimidamide (CAS 5849-66-1) is a chemical compound with molecular formula C16H17N3O3S2 and molecular weight 363.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-[(2Z)-2-anilino-2-(4-methylphenyl)sulfonyliminoethyl] carbamothioate
Also Known As: BIM-0005234.P001, AB00099225-01, F1644-0025, (Z)-2-(CARBAMOYLSULFANYL)-N'-(4-METHYLBENZENESULFONYL)-N-PHENYLETHANIMIDAMIDE, (Z)-S-(2-(phenylamino)-2-(tosylimino)ethyl) carbamothioate
| Molecular Formula | C16H17N3O3S2 |
|---|---|
| Molecular Weight | 363.07 g/mol |
| LogP | 3.00622 |
| Topological Polar Surface Area | 101.62 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 363.07114 |
| Heavy Atoms | 24 |
| Complexity | 832.63116 |
Chemical Identifiers
| CAS Number | 5849-66-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)/N=C(/CSC(=O)N)\NC2=CC=CC=C2 |
Product Overview
(Z)-2-(Carbamoylsulfanyl)-N'-(4-methylbenzenesulfonyl)-N-phenylethanimidamide (CAS 5849-66-1), with molecular formula C16H17N3O3S2 and molecular weight 363.07 g/mol. IUPAC: S-[(2Z)-2-anilino-2-(4-methylphenyl)sulfonyliminoethyl] carbamothioate.
Chemical Property Profile of (Z)-2-(Carbamoylsulfanyl)-N'-(4-methylbenzenesulfonyl)-N-phenylethanimidamide
Property Insights of (Z)-2-(Carbamoylsulfanyl)-N'-(4-methylbenzenesulfonyl)-N-phenylethanimidamide
The XLogP value of 3.00622 indicates that (Z)-2-(Carbamoylsulfanyl)-N'-(4-methylbenzenesulfonyl)-N-phenylethanimidamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.62 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-2-(Carbamoylsulfanyl)-N'-(4-methylbenzenesulfonyl)-N-phenylethanimidamide. Following Lipinski's Rule of Five, (Z)-2-(Carbamoylsulfanyl)-N'-(4-methylbenzenesulfonyl)-N-phenylethanimidamide has 2 hydrogen bond donor(s) and 4 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 (Z)-2-(Carbamoylsulfanyl)-N'-(4-methylbenzenesulfonyl)-N-phenylethanimidamide?
The CAS number of (Z)-2-(Carbamoylsulfanyl)-N'-(4-methylbenzenesulfonyl)-N-phenylethanimidamide is 5849-66-1.
What is the molecular formula of (Z)-2-(Carbamoylsulfanyl)-N'-(4-methylbenzenesulfonyl)-N-phenylethanimidamide?
The molecular formula of (Z)-2-(Carbamoylsulfanyl)-N'-(4-methylbenzenesulfonyl)-N-phenylethanimidamide is C16H17N3O3S2.
What is the molecular weight of (Z)-2-(Carbamoylsulfanyl)-N'-(4-methylbenzenesulfonyl)-N-phenylethanimidamide?
The molecular weight of (Z)-2-(Carbamoylsulfanyl)-N'-(4-methylbenzenesulfonyl)-N-phenylethanimidamide is 363.07 g/mol.
Where can I buy (Z)-2-(Carbamoylsulfanyl)-N'-(4-methylbenzenesulfonyl)-N-phenylethanimidamide?
You can request a quote for (Z)-2-(Carbamoylsulfanyl)-N'-(4-methylbenzenesulfonyl)-N-phenylethanimidamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-2-(Carbamoylsulfanyl)-N'-(4-methylbenzenesulfonyl)-N-phenylethanimidamide?
Yes, KEHONG BIO provides custom synthesis services for (Z)-2-(Carbamoylsulfanyl)-N'-(4-methylbenzenesulfonyl)-N-phenylethanimidamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.