![2-[(E)-N'-anilino-N-phenyliminocarbamimidoyl]sulfanylethyl N structure](/static/products/518/51808-08-3.png)
2-[(E)-N'-anilino-N-phenyliminocarbamimidoyl]sulfanylethyl N
TL;DR: 2-[(E)-N'-anilino-N-phenyliminocarbamimidoyl]sulfanylethyl N (CAS 51808-08-3) is a chemical compound with molecular formula C28H26N8S2 and molecular weight 538.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(N'-anilino-N-phenyliminocarbamimidoyl)sulfanylethyl N'-anilino-N-phenyliminocarbamimidothioate
Also Known As: 2-[(E)-N'-anilino-N-phenyliminocarbamimidoyl]sulfanylethyl N, 2-(N'-anilino-N-phenyliminocarbamimidoyl)sulfanylethyl N'-anilino-N-phenyliminocarbamimidothioate
| Molecular Formula | C28H26N8S2 |
|---|---|
| Molecular Weight | 538.17 g/mol |
| LogP | 9.8 |
| Topological Polar Surface Area | 149.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 13 |
| Exact Mass | 538.1722 |
| Heavy Atoms | 38 |
| Complexity | 699.0 |
Chemical Identifiers
| CAS Number | 51808-08-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)NN=C(N=NC2=CC=CC=C2)SCCSC(=NNC3=CC=CC=C3)N=NC4=CC=CC=C4 |
| InChIKey | WMUYTEXKCIDHOC-UHFFFAOYSA-N |
Product Overview
2-[(E)-N'-anilino-N-phenyliminocarbamimidoyl]sulfanylethyl N (CAS 51808-08-3), with molecular formula C28H26N8S2 and molecular weight 538.17 g/mol. IUPAC: 2-(N'-anilino-N-phenyliminocarbamimidoyl)sulfanylethyl N'-anilino-N-phenyliminocarbamimidothioate.
Chemical Property Profile of 2-[(E)-N'-anilino-N-phenyliminocarbamimidoyl]sulfanylethyl N
Property Insights of 2-[(E)-N'-anilino-N-phenyliminocarbamimidoyl]sulfanylethyl N
The XLogP value of 9.8 indicates that 2-[(E)-N'-anilino-N-phenyliminocarbamimidoyl]sulfanylethyl N is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 149.0 Ų indicates high polarity, suggesting 2-[(E)-N'-anilino-N-phenyliminocarbamimidoyl]sulfanylethyl N may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-[(E)-N'-anilino-N-phenyliminocarbamimidoyl]sulfanylethyl N has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[(E)-N'-anilino-N-phenyliminocarbamimidoyl]sulfanylethyl N?
The CAS number of 2-[(E)-N'-anilino-N-phenyliminocarbamimidoyl]sulfanylethyl N is 51808-08-3.
What is the molecular formula of 2-[(E)-N'-anilino-N-phenyliminocarbamimidoyl]sulfanylethyl N?
The molecular formula of 2-[(E)-N'-anilino-N-phenyliminocarbamimidoyl]sulfanylethyl N is C28H26N8S2.
What is the molecular weight of 2-[(E)-N'-anilino-N-phenyliminocarbamimidoyl]sulfanylethyl N?
The molecular weight of 2-[(E)-N'-anilino-N-phenyliminocarbamimidoyl]sulfanylethyl N is 538.17 g/mol.
Where can I buy 2-[(E)-N'-anilino-N-phenyliminocarbamimidoyl]sulfanylethyl N?
You can request a quote for 2-[(E)-N'-anilino-N-phenyliminocarbamimidoyl]sulfanylethyl N directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(E)-N'-anilino-N-phenyliminocarbamimidoyl]sulfanylethyl N?
Yes, KEHONG BIO provides custom synthesis services for 2-[(E)-N'-anilino-N-phenyliminocarbamimidoyl]sulfanylethyl N and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.