TL;DR: 1-Propanethiol, 2-amino- (CAS 10229-29-5) is a chemical compound with molecular formula C3H9NS and molecular weight 91.04557 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-aminopropane-1-thiol
Also Known As: 2-aminopropane-1-thiol, 2-Amino-1-propanethiol, 2-aminopropanethiol, 1-Propanethiol, 2-amino-, 2-Chlorophenoxathiin
Top 5 of 11 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C3H9NS |
| Molecular Weight | 91.04557 g/mol |
| XLogP | 0.0 |
| Topological Polar Surface Area (TPSA) | 27.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 91.04557 Da |
| Heavy Atoms | 5 |
| Complexity | 22.0 |
| SMILES | CC(CS)N |
| InChIKey | DJJIBYYAHJOUMY-UHFFFAOYSA-N |
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Propanethiol, 2-amino-. With a topological polar surface area (TPSA) of 27.0 Ų, 1-Propanethiol, 2-amino- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Propanethiol, 2-amino- has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-Propanethiol, 2-amino- is 10229-29-5.
The molecular formula of 1-Propanethiol, 2-amino- is C3H9NS.
The molecular weight of 1-Propanethiol, 2-amino- is 91.04557 g/mol.
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