Pseudourea, 2-(2-(phenylamino)ethyl)-2-thio-, dihydrobromide
TL;DR: Pseudourea, 2-(2-(phenylamino)ethyl)-2-thio-, dihydrobromide (CAS 16181-67-2) is a chemical compound with molecular formula C9H15Br2N3S and molecular weight 354.93533 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-anilinoethyl carbamimidothioate;dihydrobromide
Also Known As: Carbamimidothioic acid, 2-(phenylamino)ethyl ester, dihydrobromide, Pseudourea, 2-(2-(phenylamino)ethyl)-2-thio-, dihydrobromide, 2-(2-(Phenylamino)ethyl)-2-thiopseudourea dihydrobromide, 2-anilinoethyl carbamimidothioate dihydrobromide, 2-Anilinoethyl carbamimidothioate--hydrogen bromide (1/2)
Technical Specifications
| Molecular Formula | C9H15Br2N3S |
| Molecular Weight | 354.93533 g/mol |
| XLogP | 2.88097 |
| Topological Polar Surface Area (TPSA) | 87.2 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 354.93533 Da |
| Heavy Atoms | 15 |
| Complexity | 155.0 |
| SMILES | C1=CC=C(C=C1)NCCSC(=N)N.Br.Br |
| InChIKey | SANCGURGYZUKGI-UHFFFAOYSA-N |
Chemical Property Profile of Pseudourea, 2-(2-(phenylamino)ethyl)-2-thio-, dihydrobromide
Property Insights of Pseudourea, 2-(2-(phenylamino)ethyl)-2-thio-, dihydrobromide
The XLogP value of 2.88097 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pseudourea, 2-(2-(phenylamino)ethyl)-2-thio-, dihydrobromide. The TPSA of 87.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Pseudourea, 2-(2-(phenylamino)ethyl)-2-thio-, dihydrobromide. Following Lipinski's Rule of Five, Pseudourea, 2-(2-(phenylamino)ethyl)-2-thio-, dihydrobromide 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
What is the CAS number of Pseudourea, 2-(2-(phenylamino)ethyl)-2-thio-, dihydrobromide?
The CAS number of Pseudourea, 2-(2-(phenylamino)ethyl)-2-thio-, dihydrobromide is 16181-67-2.
What is the molecular formula of Pseudourea, 2-(2-(phenylamino)ethyl)-2-thio-, dihydrobromide?
The molecular formula of Pseudourea, 2-(2-(phenylamino)ethyl)-2-thio-, dihydrobromide is C9H15Br2N3S.
What is the molecular weight of Pseudourea, 2-(2-(phenylamino)ethyl)-2-thio-, dihydrobromide?
The molecular weight of Pseudourea, 2-(2-(phenylamino)ethyl)-2-thio-, dihydrobromide is 354.93533 g/mol.
Where can I buy Pseudourea, 2-(2-(phenylamino)ethyl)-2-thio-, dihydrobromide?
You can request a quote for Pseudourea, 2-(2-(phenylamino)ethyl)-2-thio-, dihydrobromide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Pseudourea, 2-(2-(phenylamino)ethyl)-2-thio-, dihydrobromide?
Yes, CoreyChem provides custom synthesis services for Pseudourea, 2-(2-(phenylamino)ethyl)-2-thio-, dihydrobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.