N-(2H-1,3-benzodioxol-5-yl)-2-[(4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-[(4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]acetamide
N-(2H-1,3-benzodioxol-5-yl)-2-[(4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | G681-0028 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-[(4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 429.5 |
| Molecular Formula: | C24 H19 N3 O3 S |
| Smiles: | C1C(c2ccccc2)=Nc2ccccc2N=C1SCC(Nc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4027 |
| logD: | 4.4019 |
| logSw: | -4.3664 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.454 |
| InChI Key: | PVWCTUDRAQFMTC-UHFFFAOYSA-N |