N-(3,5-dimethoxyphenyl)-2-[(4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3,5-dimethoxyphenyl)-2-[(4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]acetamide
N-(3,5-dimethoxyphenyl)-2-[(4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | G681-0017 |
| Compound Name: | N-(3,5-dimethoxyphenyl)-2-[(4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 445.54 |
| Molecular Formula: | C25 H23 N3 O3 S |
| Smiles: | COc1cc(cc(c1)OC)NC(CSC1CC(c2ccccc2)=Nc2ccccc2N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7087 |
| logD: | 4.7077 |
| logSw: | -4.4212 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.426 |
| InChI Key: | IDRPFTSEDCPVAP-UHFFFAOYSA-N |