N-benzyl-N-phenyl-2-[(9H-purin-6-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-benzyl-N-phenyl-2-[(9H-purin-6-yl)sulfanyl]acetamide
N-benzyl-N-phenyl-2-[(9H-purin-6-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | D691-0095 |
| Compound Name: | N-benzyl-N-phenyl-2-[(9H-purin-6-yl)sulfanyl]acetamide |
| Molecular Weight: | 375.45 |
| Molecular Formula: | C20 H17 N5 O S |
| Smiles: | C(c1ccccc1)N(C(CSc1c2c(ncn1)[nH]cn2)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.0654 |
| logD: | 3.0652 |
| logSw: | -3.2187 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.63 |
| InChI Key: | JNDXPHNGPSRPMG-UHFFFAOYSA-N |