ethyl 3-{2-[7,8-dimethyl-2-oxo-4-(thiophen-2-yl)-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]acetamido}benzoate
Chemical Structure Depiction of
ethyl 3-{2-[7,8-dimethyl-2-oxo-4-(thiophen-2-yl)-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]acetamido}benzoate
ethyl 3-{2-[7,8-dimethyl-2-oxo-4-(thiophen-2-yl)-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]acetamido}benzoate
Compound characteristics
| Compound ID: | F402-0381 |
| Compound Name: | ethyl 3-{2-[7,8-dimethyl-2-oxo-4-(thiophen-2-yl)-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]acetamido}benzoate |
| Molecular Weight: | 475.57 |
| Molecular Formula: | C26 H25 N3 O4 S |
| Smiles: | CCOC(c1cccc(c1)NC(CN1C(CC(c2cccs2)=Nc2cc(C)c(C)cc12)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6071 |
| logD: | 5.6071 |
| logSw: | -5.3961 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.511 |
| InChI Key: | WXKGPGCEJJRDQC-UHFFFAOYSA-N |