4-[(4-bromophenyl)sulfanyl]-3-nitro-N-pentylbenzamide
Chemical Structure Depiction of
4-[(4-bromophenyl)sulfanyl]-3-nitro-N-pentylbenzamide
4-[(4-bromophenyl)sulfanyl]-3-nitro-N-pentylbenzamide
Compound characteristics
| Compound ID: | K781-5392 |
| Compound Name: | 4-[(4-bromophenyl)sulfanyl]-3-nitro-N-pentylbenzamide |
| Molecular Weight: | 423.33 |
| Molecular Formula: | C18 H19 Br N2 O3 S |
| Smiles: | CCCCCNC(c1ccc(c(c1)[N+]([O-])=O)Sc1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 6.1151 |
| logD: | 6.1151 |
| logSw: | -5.2897 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.574 |
| InChI Key: | BOSNLHOCWAYLRD-UHFFFAOYSA-N |