ethyl [4-({2-oxo-2-[(3-phenylpropyl)amino]ethyl}sulfanyl)-1H-1,5-benzodiazepin-2-yl]acetate
Chemical Structure Depiction of
ethyl [4-({2-oxo-2-[(3-phenylpropyl)amino]ethyl}sulfanyl)-1H-1,5-benzodiazepin-2-yl]acetate
ethyl [4-({2-oxo-2-[(3-phenylpropyl)amino]ethyl}sulfanyl)-1H-1,5-benzodiazepin-2-yl]acetate
Compound characteristics
| Compound ID: | F405-0321 |
| Compound Name: | ethyl [4-({2-oxo-2-[(3-phenylpropyl)amino]ethyl}sulfanyl)-1H-1,5-benzodiazepin-2-yl]acetate |
| Molecular Weight: | 437.56 |
| Molecular Formula: | C24 H27 N3 O3 S |
| Smiles: | CCOC(CC1=CC(=Nc2ccccc2N1)SCC(NCCCc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.21 |
| logD: | 4.21 |
| logSw: | -4.1538 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.647 |
| InChI Key: | SAZMFIHUNZMBNU-UHFFFAOYSA-N |