N-(3-fluoro-4-methylphenyl)-2-[(9H-purin-6-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3-fluoro-4-methylphenyl)-2-[(9H-purin-6-yl)sulfanyl]acetamide
N-(3-fluoro-4-methylphenyl)-2-[(9H-purin-6-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | D691-0029 |
| Compound Name: | N-(3-fluoro-4-methylphenyl)-2-[(9H-purin-6-yl)sulfanyl]acetamide |
| Molecular Weight: | 317.34 |
| Molecular Formula: | C14 H12 F N5 O S |
| Smiles: | Cc1ccc(cc1F)NC(CSc1c2c(ncn1)[nH]cn2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0967 |
| logD: | 2.0965 |
| logSw: | -2.7991 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.684 |
| InChI Key: | BWUZVFPIARUGLN-UHFFFAOYSA-N |