Pseudourea, 2-(3-aminopropyl)-2-thio-, dihydrobromide
TL;DR: Pseudourea, 2-(3-aminopropyl)-2-thio-, dihydrobromide (CAS 7072-40-4) is a chemical compound with molecular formula C4H13Br2N3S and molecular weight 292.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-aminopropyl carbamimidothioate;dihydrobromide
Also Known As: APT (radioprotective), vinylphenylacetate, S-(3-Aminopropyl)-ITU dihydrobromide, 3-Aminopropylisothiourea dihydrobromide, 3-Aminopropylthiopseudourea dihydrobromide
| Molecular Formula | C4H13Br2N3S |
|---|---|
| Molecular Weight | 292.92 g/mol |
| LogP | 1.11767 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 292.91968 |
| Heavy Atoms | 10 |
| Complexity | 73.0 |
Chemical Identifiers
| CAS Number | 7072-40-4 |
|---|---|
| SMILES | C(CN)CSC(=N)N.Br.Br |
| InChIKey | JBTDFRNUVWFUGL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pseudourea, 2-(3-aminopropyl)-2-thio-, dihydrobromide (CAS 7072-40-4), with molecular formula C4H13Br2N3S and molecular weight 292.92 g/mol. IUPAC: 3-aminopropyl carbamimidothioate;dihydrobromide.
Chemical Property Profile of Pseudourea, 2-(3-aminopropyl)-2-thio-, dihydrobromide
Property Insights of Pseudourea, 2-(3-aminopropyl)-2-thio-, dihydrobromide
The XLogP value of 1.11767 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pseudourea, 2-(3-aminopropyl)-2-thio-, dihydrobromide. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Pseudourea, 2-(3-aminopropyl)-2-thio-, dihydrobromide. Following Lipinski's Rule of Five, Pseudourea, 2-(3-aminopropyl)-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
Frequently Asked Questions
What is the CAS number of Pseudourea, 2-(3-aminopropyl)-2-thio-, dihydrobromide?
The CAS number of Pseudourea, 2-(3-aminopropyl)-2-thio-, dihydrobromide is 7072-40-4.
What is the molecular formula of Pseudourea, 2-(3-aminopropyl)-2-thio-, dihydrobromide?
The molecular formula of Pseudourea, 2-(3-aminopropyl)-2-thio-, dihydrobromide is C4H13Br2N3S.
What is the molecular weight of Pseudourea, 2-(3-aminopropyl)-2-thio-, dihydrobromide?
The molecular weight of Pseudourea, 2-(3-aminopropyl)-2-thio-, dihydrobromide is 292.92 g/mol.
Where can I buy Pseudourea, 2-(3-aminopropyl)-2-thio-, dihydrobromide?
You can request a quote for Pseudourea, 2-(3-aminopropyl)-2-thio-, dihydrobromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pseudourea, 2-(3-aminopropyl)-2-thio-, dihydrobromide?
Yes, KEHONG BIO provides custom synthesis services for Pseudourea, 2-(3-aminopropyl)-2-thio-, dihydrobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.