TL;DR: 2,3-Diaminopropane-1-thiol (CAS 133560-02-8) is a chemical compound with molecular formula C3H10N2S and molecular weight 106.05647 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,3-diaminopropane-1-thiol
Also Known As: 2,3-diaminopropane-1-thiol
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C3H10N2S |
| Molecular Weight | 106.05647 g/mol |
| XLogP | -1.3 |
| Topological Polar Surface Area (TPSA) | 53.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 106.05647 Da |
| Heavy Atoms | 6 |
| Complexity | 32.0 |
| SMILES | C(C(CS)N)N |
| InChIKey | KFCAJDUOSGKVSB-UHFFFAOYSA-N |
The XLogP value of -1.3 indicates that 2,3-Diaminopropane-1-thiol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 53.0 Ų, 2,3-Diaminopropane-1-thiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-Diaminopropane-1-thiol has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2,3-Diaminopropane-1-thiol is 133560-02-8.
The molecular formula of 2,3-Diaminopropane-1-thiol is C3H10N2S.
The molecular weight of 2,3-Diaminopropane-1-thiol is 106.05647 g/mol.
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