1-Anilino-6-phenyl-2,5-dithiobiurea
TL;DR: 1-Anilino-6-phenyl-2,5-dithiobiurea (CAS 52147-62-3) is a chemical compound with molecular formula C14H15N5S2 and molecular weight 317.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-anilino-3-(phenylcarbamothioylamino)thiourea
Also Known As: 1-ANILINO-6-PHENYL-2,5-DITHIOBIUREA, 1-anilino-3-(phenylcarbamothioylamino)thiourea, 3-(anilinothiocarbamoylamino)-1-phenyl-thiourea, 653-731-8, RefChem:429461
| Molecular Formula | C14H15N5S2 |
|---|---|
| Molecular Weight | 317.08 g/mol |
| LogP | 2.3792 |
| Topological Polar Surface Area | 60.15 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 317.07687 |
| Heavy Atoms | 21 |
| Complexity | 588.82806 |
Chemical Identifiers
| CAS Number | 52147-62-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=S)NNC(=S)NNC2=CC=CC=C2 |
Product Overview
1-Anilino-6-phenyl-2,5-dithiobiurea (CAS 52147-62-3), with molecular formula C14H15N5S2 and molecular weight 317.08 g/mol. IUPAC: 1-anilino-3-(phenylcarbamothioylamino)thiourea.
Chemical Property Profile of 1-Anilino-6-phenyl-2,5-dithiobiurea
Property Insights of 1-Anilino-6-phenyl-2,5-dithiobiurea
The XLogP value of 2.3792 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Anilino-6-phenyl-2,5-dithiobiurea. The TPSA of 60.15 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Anilino-6-phenyl-2,5-dithiobiurea. Following Lipinski's Rule of Five, 1-Anilino-6-phenyl-2,5-dithiobiurea has 5 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 1-Anilino-6-phenyl-2,5-dithiobiurea?
The CAS number of 1-Anilino-6-phenyl-2,5-dithiobiurea is 52147-62-3.
What is the molecular formula of 1-Anilino-6-phenyl-2,5-dithiobiurea?
The molecular formula of 1-Anilino-6-phenyl-2,5-dithiobiurea is C14H15N5S2.
What is the molecular weight of 1-Anilino-6-phenyl-2,5-dithiobiurea?
The molecular weight of 1-Anilino-6-phenyl-2,5-dithiobiurea is 317.08 g/mol.
Where can I buy 1-Anilino-6-phenyl-2,5-dithiobiurea?
You can request a quote for 1-Anilino-6-phenyl-2,5-dithiobiurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Anilino-6-phenyl-2,5-dithiobiurea?
Yes, KEHONG BIO provides custom synthesis services for 1-Anilino-6-phenyl-2,5-dithiobiurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.