3-nitro-5-[(3-phenylpropyl)sulfanyl]aniline
Chemical Structure Depiction of
3-nitro-5-[(3-phenylpropyl)sulfanyl]aniline
3-nitro-5-[(3-phenylpropyl)sulfanyl]aniline
Compound characteristics
| Compound ID: | R314-0023 |
| Compound Name: | 3-nitro-5-[(3-phenylpropyl)sulfanyl]aniline |
| Molecular Weight: | 288.37 |
| Molecular Formula: | C15 H16 N2 O2 S |
| Smiles: | C(Cc1ccccc1)CSc1cc(cc(c1)[N+]([O-])=O)N |
| Stereo: | ACHIRAL |
| logP: | 4.4375 |
| logD: | 4.4375 |
| logSw: | -4.5974 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.154 |
| InChI Key: | VXWWJBQNXCOYDB-UHFFFAOYSA-N |