N-(4-bromo-2-fluorophenyl)-2-[(9H-purin-6-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(4-bromo-2-fluorophenyl)-2-[(9H-purin-6-yl)sulfanyl]acetamide
N-(4-bromo-2-fluorophenyl)-2-[(9H-purin-6-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | D691-0025 |
| Compound Name: | N-(4-bromo-2-fluorophenyl)-2-[(9H-purin-6-yl)sulfanyl]acetamide |
| Molecular Weight: | 382.21 |
| Molecular Formula: | C13 H9 Br F N5 O S |
| Smiles: | C(C(Nc1ccc(cc1F)[Br])=O)Sc1c2c(ncn1)[nH]cn2 |
| Stereo: | ACHIRAL |
| logP: | 2.1275 |
| logD: | 2.1182 |
| logSw: | -2.93 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.986 |
| InChI Key: | SHAGZONXALKCHZ-UHFFFAOYSA-N |