N-[(3-methoxyphenyl)methyl]-2-[(4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[(3-methoxyphenyl)methyl]-2-[(4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]acetamide
N-[(3-methoxyphenyl)methyl]-2-[(4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | G681-0065 |
| Compound Name: | N-[(3-methoxyphenyl)methyl]-2-[(4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 429.54 |
| Molecular Formula: | C25 H23 N3 O2 S |
| Smiles: | COc1cccc(CNC(CSC2CC(c3ccccc3)=Nc3ccccc3N=2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.3482 |
| logD: | 4.3335 |
| logSw: | -4.3804 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.205 |
| InChI Key: | ARNWHMAUJFWUTQ-UHFFFAOYSA-N |