N-[(5-methylthiophen-2-yl)methyl]heptan-1-amine--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-[(5-methylthiophen-2-yl)methyl]heptan-1-amine--hydrogen chloride (1/1)
N-[(5-methylthiophen-2-yl)methyl]heptan-1-amine--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8104-02744 |
| Compound Name: | N-[(5-methylthiophen-2-yl)methyl]heptan-1-amine--hydrogen chloride (1/1) |
| Molecular Weight: | 261.85 |
| Molecular Formula: | C13 H23 N S |
| Salt: | HCl |
| Smiles: | [H]N(CCCCCCC)Cc1ccc(C)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.3006 |
| logD: | 1.4409 |
| logSw: | -4.2272 |
| Hydrogen bond acceptors count: | 1 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 13.1356 |
| InChI Key: | KPQGAWVBEGAHQG-UHFFFAOYSA-N |